Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L1JQ3V
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| Ligand Name |
N-{(1S,2R)-1-Benzyl-2-hydroxy-3-[(3-methoxybenzyl)amino]propyl}-8-ethyl-1-methyl-3,4,7,8-tetrahydro-1H,6H-[1,2,5]thiadiazepino[5,4,3-DE]quinoxaline-10-carboxamide 2,2-dioxide
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| Synonyms |
N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}-8-ETHYL-1-METHYL-3,4,7,8-TETRAHYDRO-1H,6H-[1,2,5]THIADIAZEPINO[5,4,3-DE]QUINOXALINE-10-CARBOXAMIDE 2,2-DIOXIDE; Q27468096
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| Structure |
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Download2D MOL |
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| Formula |
C32H41N5O5S
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| Canonical SMILES |
CCN1CCN2CCS(=O)(=O)N(C3=C2C1=CC(=C3)C(=O)NC(CC4=CC=CC=C4)C(CNCC5=CC(=CC=C5)OC)O)C
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| InChI |
1S/C32H41N5O5S/c1-4-36-13-14-37-15-16-43(40,41)35(2)28-19-25(20-29(36)31(28)37)32(39)34-27(18-23-9-6-5-7-10-23)30(38)22-33-21-24-11-8-12-26(17-24)42-3/h5-12,17,19-20,27,30,33,38H,4,13-16,18,21-22H2,1-3H3,(H,34,39)/t27-,30+/m0/s1
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| InChIKey |
UKAHVQYVCSVAKY-BHBYDHKZSA-N
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| PubChem Compound ID | ||||
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