2-(4-methoxyphenyl)-1-oxidanylidene-3-pyridin-3-yl-N-(pyridin-4-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-(4-methoxyphenyl)-1-oxidanylidene-3-pyridin-3-yl-N-(pyridin-4-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-(4-methoxyphenyl)-1-oxo-3-(3-pyridyl)-N-(4-pyridylmethyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-(4-methoxyphenyl)-1-oxo-3-(3-pyridinyl)-N-(pyridin-4-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-(4-methoxyphenyl)-1-oxo-3-pyridin-3-yl-N-(pyridin-4-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 1-keto-2-(4-methoxyphenyl)-3-(3-pyridyl)-N-(4-pyridylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C28H24N4O3 MolecularWeight: 464.51516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(C3=CC=CC=C3C2=O)C(=O)NCC4=CC=NC=C4)C5=CN=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C(C(C3=CC=CC=C3C2=O)C(=O)NCC4=CC=NC=C4)C5=CN=CC=C5

InChI

InChI=1S/C28H24N4O3/c1-35-22-10-8-21(9-11-22)32-26(20-5-4-14-30-18-20)25(23-6-2-3-7-24(23)28(32)34)27(33)31-17-19-12-15-29-16-13-19/h2-16,18,25-26H,17H2,1H3,(H,31,33)