2-methoxyethyl 2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)pyrrol-3-yl]prop-2-enoate

Systemtic Name: 2-methoxyethyl 2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)pyrrol-3-yl]prop-2-enoate Openeye Name: 2-methoxyethyl 2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-oxo-quinazolin-3-yl)pyrrol-3-yl]prop-2-enoate CAS Name: 2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-oxo-3-quinazolinyl)-3-pyrrolyl]-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-cyano-3-[2,5-dimethyl-1-(2-methyl-4-oxoquinazolin-3-yl)pyrrol-3-yl]prop-2-enoate Traditional Name: 2-cyano-3-[1-(4-keto-2-methyl-quinazolin-3-yl)-2,5-dimethyl-pyrrol-3-yl]acrylic acid 2-methoxyethyl ester Formula: C22H22N4O4 MolecularWeight: 406.43448

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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)OCCOC

Isomeric SMILES

CC1=CC(=C(N1N2C(=NC3=CC=CC=C3C2=O)C)C)C=C(C#N)C(=O)OCCOC

InChI

InChI=1S/C22H22N4O4/c1-14-11-17(12-18(13-23)22(28)30-10-9-29-4)15(2)25(14)26-16(3)24-20-8-6-5-7-19(20)21(26)27/h5-8,11-12H,9-10H2,1-4H3