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

Systemtic Name: N-(4-ethanoylphenyl)-2-[4-oxidanylidene-3-(phenylmethyl)pyrimido[5,4-b]indol-5-yl]ethanamide Openeye Name: N-(4-acetylphenyl)-2-(3-benzyl-4-oxo-pyrimido[5,4-b]indol-5-yl)acetamide CAS Name: N-(4-acetylphenyl)-2-[4-oxo-3-(phenylmethyl)-5-pyrimido[5,4-b]indolyl]acetamide IUPAC Name: N-(4-acetylphenyl)-2-(3-benzyl-4-oxopyrimido[5,4-b]indol-5-yl)acetamide Traditional Name: N-(4-acetylphenyl)-2-(3-benzyl-4-keto-pyrimid[5,4-b]indol-5-yl)acetamide Formula: C27H22N4O3 MolecularWeight: 450.48858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H22N4O3/c1-18(32)20-11-13-21(14-12-20)29-24(33)16-31-23-10-6-5-9-22(23)25-26(31)27(34)30(17-28-25)15-19-7-3-2-4-8-19/h2-14,17H,15-16H2,1H3,(H,29,33)