propan-2-yl 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-pyridin-2-ylsulfonyl-amino]methyl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-pyridin-2-ylsulfonyl-amino]methyl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(2-pyridylsulfonyl)amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(2-pyridinylsulfonyl)amino]methyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-pyridin-2-ylsulfonylamino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(2-pyridylsulfonyl)amino]methyl]piperidine-1-carboxylic acid isopropyl ester Formula: C30H37N7O4S MolecularWeight: 591.72428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)CN(C2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CN=CN4C)S(=O)(=O)C5=CC=CC=N5

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)CN(C2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CN=CN4C)S(=O)(=O)C5=CC=CC=N5

InChI

InChI=1S/C30H37N7O4S/c1-22(2)41-30(38)35-12-9-23(10-13-35)18-37(42(39,40)29-6-4-5-11-33-29)26-15-25-14-24(16-31)7-8-28(25)36(19-26)20-27-17-32-21-34(27)3/h4-8,11,14,17,21-23,26H,9-10,12-13,15,18-20H2,1-3H3