3-(2,3-dimethylphenyl)-N-(4-ethylsulfonylphenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(2,3-dimethylphenyl)-N-(4-ethylsulfonylphenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(2,3-dimethylphenyl)-N-(4-ethylsulfonylphenyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(2,3-dimethylphenyl)-N-(4-ethylsulfonylphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(2,3-dimethylphenyl)-N-(4-ethylsulfonylphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(2,3-dimethylphenyl)-N-(4-esylphenyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C25H23N3O4S2 MolecularWeight: 493.59782

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC(=C4C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC(=C4C)C

InChI

InChI=1S/C25H23N3O4S2/c1-4-34(31,32)19-11-9-18(10-12-19)26-23(29)17-8-13-20-21(14-17)27-25(33)28(24(20)30)22-7-5-6-15(2)16(22)3/h5-14H,4H2,1-3H3,(H,26,29)(H,27,33)