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

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)butanoate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 4-(2-methyl-4-oxo-quinazolin-3-yl)butanoate CAS Name: 4-(2-methyl-4-oxo-3-quinazolinyl)butanoic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 4-(2-methyl-4-oxoquinazolin-3-yl)butanoate Traditional Name: 4-(4-keto-2-methyl-quinazolin-3-yl)butyric acid [4-(2-thenoylamino)phenyl] ester Formula: C24H21N3O4S MolecularWeight: 447.50624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C24H21N3O4S/c1-16-25-20-7-3-2-6-19(20)24(30)27(16)14-4-9-22(28)31-18-12-10-17(11-13-18)26-23(29)21-8-5-15-32-21/h2-3,5-8,10-13,15H,4,9,14H2,1H3,(H,26,29)