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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3-methylphenyl)carbamoylamino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(m-tolylcarbamoylamino)-N-(3-pyridylmethyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(3-methylanilino)-oxomethyl]amino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3-methylphenyl)carbamoylamino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(m-tolylcarbamoylamino)-N-(3-pyridylmethyl)benzamide Formula: C30H29N5O2 MolecularWeight: 491.58356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C30H29N5O2/c1-21-6-4-10-25(16-21)33-30(37)34-26-11-12-28(35-15-13-23-8-2-3-9-24(23)20-35)27(17-26)29(36)32-19-22-7-5-14-31-18-22/h2-12,14,16-18H,13,15,19-20H2,1H3,(H,32,36)(H2,33,34,37)