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

Systemtic Name: 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-pyridin-2-ylsulfonyl-amino]methyl]-N-propan-2-yl-piperidine-1-carboxamide Openeye Name: 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(2-pyridylsulfonyl)amino]methyl]-N-isopropyl-piperidine-1-carboxamide CAS Name: 4-[[[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(2-pyridinylsulfonyl)amino]methyl]-N-propan-2-yl-1-piperidinecarboxamide IUPAC Name: 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-pyridin-2-ylsulfonylamino]methyl]-N-propan-2-ylpiperidine-1-carboxamide Traditional Name: 4-[[[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-(2-pyridylsulfonyl)amino]methyl]-N-isopropyl-piperidine-1-carboxamide Formula: C30H38N8O3S MolecularWeight: 590.73952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=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)NC(=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/C30H38N8O3S/c1-22(2)34-30(39)36-12-9-23(10-13-36)18-38(42(40,41)29-6-4-5-11-33-29)26-15-25-14-24(16-31)7-8-28(25)37(19-26)20-27-17-32-21-35(27)3/h4-8,11,14,17,21-23,26H,9-10,12-13,15,18-20H2,1-3H3,(H,34,39)