N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-3-pyrrol-1-yl-quinazoline-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-3-pyrrol-1-yl-quinazoline-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3-pyrrol-1-yl-quinazoline-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3-(1-pyrrolyl)-2-quinazolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3-pyrrol-1-ylquinazoline-2-carboxamide Traditional Name: N-homoveratryl-4-keto-3-pyrrol-1-yl-quinazoline-2-carboxamide Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=NC3=CC=CC=C3C(=O)N2N4C=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=NC3=CC=CC=C3C(=O)N2N4C=CC=C4)OC

InChI

InChI=1S/C23H22N4O4/c1-30-19-10-9-16(15-20(19)31-2)11-12-24-22(28)21-25-18-8-4-3-7-17(18)23(29)27(21)26-13-5-6-14-26/h3-10,13-15H,11-12H2,1-2H3,(H,24,28)