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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-methylphenyl)carbonylamino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-methylbenzoyl)amino]-N-(3-pyridylmethyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(2-methylphenyl)-oxomethyl]amino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-methylbenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(o-toluoylamino)-N-(3-pyridylmethyl)benzamide Formula: C30H28N4O2 MolecularWeight: 476.56892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C30H28N4O2/c1-21-7-2-5-11-26(21)30(36)33-25-12-13-28(34-16-14-23-9-3-4-10-24(23)20-34)27(17-25)29(35)32-19-22-8-6-15-31-18-22/h2-13,15,17-18H,14,16,19-20H2,1H3,(H,32,35)(H,33,36)