N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[4-(3,4-dimethylphenyl)-2-thiazolyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C22H20N4O2S2 MolecularWeight: 436.5498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S)C

InChI

InChI=1S/C22H20N4O2S2/c1-13-7-8-15(11-14(13)2)18-12-30-21(23-18)25-19(27)9-10-26-20(28)16-5-3-4-6-17(16)24-22(26)29/h3-8,11-12H,9-10H2,1-2H3,(H,24,29)(H,23,25,27)