N-(4-methylphenyl)-2-[4-oxidanylidene-3-(phenylmethyl)pyrimido[5,4-b]indol-5-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-oxidanylidene-3-(phenylmethyl)pyrimido[5,4-b]indol-5-yl]ethanamide Openeye Name: 2-(3-benzyl-4-oxo-pyrimido[5,4-b]indol-5-yl)-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[4-oxo-3-(phenylmethyl)-5-pyrimido[5,4-b]indolyl]acetamide IUPAC Name: 2-(3-benzyl-4-oxopyrimido[5,4-b]indol-5-yl)-N-(4-methylphenyl)acetamide Traditional Name: 2-(3-benzyl-4-keto-pyrimid[5,4-b]indol-5-yl)-N-(p-tolyl)acetamide Formula: C26H22N4O2 MolecularWeight: 422.47848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3C4=C2C(=O)N(C=N4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3C4=C2C(=O)N(C=N4)CC5=CC=CC=C5

InChI

InChI=1S/C26H22N4O2/c1-18-11-13-20(14-12-18)28-23(31)16-30-22-10-6-5-9-21(22)24-25(30)26(32)29(17-27-24)15-19-7-3-2-4-8-19/h2-14,17H,15-16H2,1H3,(H,28,31)