ethyl (E)-2-cyano-3-[4-[4-(4-oxidanylidenequinazolin-3-yl)butanoylamino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[4-[4-(4-oxidanylidenequinazolin-3-yl)butanoylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[4-[4-(4-oxoquinazolin-3-yl)butanoylamino]phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-[[1-oxo-4-(4-oxo-3-quinazolinyl)butyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[4-[4-(4-oxoquinazolin-3-yl)butanoylamino]phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-[4-(4-ketoquinazolin-3-yl)butanoylamino]phenyl]acrylic acid ethyl ester Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=C(C=C1)NC(=O)CCCN2C=NC3=CC=CC=C3C2=O)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=C(C=C1)NC(=O)CCCN2C=NC3=CC=CC=C3C2=O)/C#N

InChI

InChI=1S/C24H22N4O4/c1-2-32-24(31)18(15-25)14-17-9-11-19(12-10-17)27-22(29)8-5-13-28-16-26-21-7-4-3-6-20(21)23(28)30/h3-4,6-7,9-12,14,16H,2,5,8,13H2,1H3,(H,27,29)/b18-14+