2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)pyrrol-3-yl]-N-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: 2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)pyrrol-3-yl]-N-(4-methoxyphenyl)prop-2-enamide Openeye Name: 2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-oxo-quinazolin-3-yl)pyrrol-3-yl]-N-(4-methoxyphenyl)prop-2-enamide CAS Name: 2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-oxo-3-quinazolinyl)-3-pyrrolyl]-N-(4-methoxyphenyl)-2-propenamide IUPAC Name: 2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-oxoquinazolin-3-yl)pyrrol-3-yl]-N-(4-methoxyphenyl)prop-2-enamide Traditional Name: 2-cyano-3-[1-(4-keto-2-methyl-quinazolin-3-yl)-2,5-dimethyl-pyrrol-3-yl]-N-(4-methoxyphenyl)acrylamide Formula: C26H23N5O3 MolecularWeight: 453.49252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1N2C(=NC3=CC=CC=C3C2=O)C)C)C=C(C#N)C(=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=C(N1N2C(=NC3=CC=CC=C3C2=O)C)C)C=C(C#N)C(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H23N5O3/c1-16-13-19(14-20(15-27)25(32)29-21-9-11-22(34-4)12-10-21)17(2)30(16)31-18(3)28-24-8-6-5-7-23(24)26(31)33/h5-14H,1-4H3,(H,29,32)