Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LD8CP6
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| Ligand Name |
(2R)-N-(3-cyanophenyl)-2-(3-{[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]carbamoyl}phenyl)pyrrolidine-1-carboxamide
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| Synonyms |
(2R)-N-(3-cyanophenyl)-2-(3-{[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]carbamoyl}phenyl)pyrrolidine-1-carboxamide; CHEMBL3700932; SCHEMBL10311058; BDBM169504; US9079880, 37; B4Y
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| Structure |
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Download2D MOL |
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| Formula |
C28H30N6O2S
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| Canonical SMILES |
CN(C)C1CCC2=C(C1)SC(=N2)NC(=O)C3=CC=CC(=C3)C4CCCN4C(=O)NC5=CC=CC(=C5)C#N
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| InChI |
1S/C28H30N6O2S/c1-33(2)22-11-12-23-25(16-22)37-27(31-23)32-26(35)20-8-4-7-19(15-20)24-10-5-13-34(24)28(36)30-21-9-3-6-18(14-21)17-29/h3-4,6-9,14-15,22,24H,5,10-13,16H2,1-2H3,(H,30,36)(H,31,32,35)/t22-,24+/m0/s1
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| InChIKey |
HOQOXPZIFORKKX-LADGPHEKSA-N
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| PubChem Compound ID | ||||
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