[4-(thiophen-2-ylcarbonylamino)phenyl] 2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 2-(8-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 2-(8-methyl-4-oxo-quinazolin-3-yl)acetate CAS Name: 2-(8-methyl-4-oxo-3-quinazolinyl)acetic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 2-(8-methyl-4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(4-keto-8-methyl-quinazolin-3-yl)acetic acid [4-(2-thenoylamino)phenyl] ester Formula: C22H17N3O4S MolecularWeight: 419.45308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H17N3O4S/c1-14-4-2-5-17-20(14)23-13-25(22(17)28)12-19(26)29-16-9-7-15(8-10-16)24-21(27)18-6-3-11-30-18/h2-11,13H,12H2,1H3,(H,24,27)