N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-2-[(3-methylphenyl)carbamoylamino]-N-phenyl-ethanamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-2-[(3-methylphenyl)carbamoylamino]-N-phenyl-ethanamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-2-(m-tolylcarbamoylamino)-N-phenyl-acetamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-[[(3-methylanilino)-oxomethyl]amino]-N-phenylacetamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-[(3-methylphenyl)carbamoylamino]-N-phenylacetamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-2-(m-tolylcarbamoylamino)-N-phenyl-acetamide Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCC(=O)N(CC(=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCC(=O)N(CC(=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4O3/c1-20-8-7-11-23(16-20)29-27(34)28-17-25(32)31(24-12-3-2-4-13-24)19-26(33)30-15-14-21-9-5-6-10-22(21)18-30/h2-13,16H,14-15,17-19H2,1H3,(H2,28,29,34)