3-(1-cyclopentylcarbonylpiperidin-4-yl)-3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-N-(2-pyrrolidin-1-ylethyl)propanamide

Systemtic Name: 3-(1-cyclopentylcarbonylpiperidin-4-yl)-3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-N-(2-pyrrolidin-1-ylethyl)propanamide Openeye Name: 3-[1-(cyclopentanecarbonyl)-4-piperidyl]-3-[4-(7-methoxy-8-quinolyl)-1,4-diazepan-1-yl]-N-(2-pyrrolidin-1-ylethyl)propanamide CAS Name: 3-[1-[cyclopentyl(oxo)methyl]-4-piperidinyl]-3-[4-(7-methoxy-8-quinolinyl)-1,4-diazepan-1-yl]-N-[2-(1-pyrrolidinyl)ethyl]propanamide IUPAC Name: 3-[1-(cyclopentanecarbonyl)piperidin-4-yl]-3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-N-(2-pyrrolidin-1-ylethyl)propanamide Traditional Name: 3-[1-(cyclopentanecarbonyl)-4-piperidyl]-3-[4-(7-methoxy-8-quinolyl)-1,4-diazepan-1-yl]-N-(2-pyrrolidinoethyl)propionamide Formula: C35H52N6O3 MolecularWeight: 604.82578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=CC=N2)C=C1)N3CCCN(CC3)C(CC(=O)NCCN4CCCC4)C5CCN(CC5)C(=O)C6CCCC6

Isomeric SMILES

COC1=C(C2=C(C=CC=N2)C=C1)N3CCCN(CC3)C(CC(=O)NCCN4CCCC4)C5CCN(CC5)C(=O)C6CCCC6

InChI

InChI=1S/C35H52N6O3/c1-44-31-12-11-28-10-6-15-37-33(28)34(31)40-20-7-19-39(24-25-40)30(26-32(42)36-16-23-38-17-4-5-18-38)27-13-21-41(22-14-27)35(43)29-8-2-3-9-29/h6,10-12,15,27,29-30H,2-5,7-9,13-14,16-26H2,1H3,(H,36,42)