2-cyclopropyl-3-(3-methylphenyl)-1-oxidanylidene-N-(pyridin-4-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-3-(3-methylphenyl)-1-oxidanylidene-N-(pyridin-4-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-cyclopropyl-3-(m-tolyl)-1-oxo-N-(4-pyridylmethyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-cyclopropyl-3-(3-methylphenyl)-1-oxo-N-(pyridin-4-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-cyclopropyl-3-(3-methylphenyl)-1-oxo-N-(pyridin-4-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-cyclopropyl-1-keto-3-(m-tolyl)-N-(4-pyridylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C26H25N3O2 MolecularWeight: 411.4956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCC5=CC=NC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCC5=CC=NC=C5

InChI

InChI=1S/C26H25N3O2/c1-17-5-4-6-19(15-17)24-23(25(30)28-16-18-11-13-27-14-12-18)21-7-2-3-8-22(21)26(31)29(24)20-9-10-20/h2-8,11-15,20,23-24H,9-10,16H2,1H3,(H,28,30)