2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3,5-dimethoxyphenyl)carbonylamino]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3,5-dimethoxyphenyl)carbonylamino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3,5-dimethoxybenzoyl)amino]-N-(3-pyridylmethyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3,5-dimethoxybenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3,5-dimethoxybenzoyl)amino]-N-(3-pyridylmethyl)benzamide Formula: C31H30N4O4 MolecularWeight: 522.5943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCC5=CN=CC=C5)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCC5=CN=CC=C5)OC

InChI

InChI=1S/C31H30N4O4/c1-38-26-14-24(15-27(17-26)39-2)30(36)34-25-9-10-29(35-13-11-22-7-3-4-8-23(22)20-35)28(16-25)31(37)33-19-21-6-5-12-32-18-21/h3-10,12,14-18H,11,13,19-20H2,1-2H3,(H,33,37)(H,34,36)