[4-(thiophen-2-ylcarbonylamino)phenyl] 3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanoate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 3-(2-methyl-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-(2-methyl-4-oxo-3-quinazolinyl)propanoic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 3-(2-methyl-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-keto-2-methyl-quinazolin-3-yl)propionic acid [4-(2-thenoylamino)phenyl] ester Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H19N3O4S/c1-15-24-19-6-3-2-5-18(19)23(29)26(15)13-12-21(27)30-17-10-8-16(9-11-17)25-22(28)20-7-4-14-31-20/h2-11,14H,12-13H2,1H3,(H,25,28)