ethyl (E)-3-[4-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoylamino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[[2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylacetyl]amino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[1-oxo-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]ethyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[[2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetyl]amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[[2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetyl]amino]phenyl]acrylic acid ethyl ester Formula: C27H23N3O4S MolecularWeight: 485.55422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)/C=C/C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C27H23N3O4S/c1-2-34-25(32)17-14-19-12-15-20(16-13-19)28-24(31)18-35-27-29-23-11-7-6-10-22(23)26(33)30(27)21-8-4-3-5-9-21/h3-17H,2,18H2,1H3,(H,28,31)/b17-14+