N-[4-[[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-[4-[[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-[4-[[3-(2,6-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]thiazol-2-yl]acetamide CAS Name: N-[4-[[[3-(2,6-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]methyl]-2-thiazolyl]acetamide IUPAC Name: N-[4-[[3-(2,6-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-[4-[[[3-(2,6-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]methyl]thiazol-2-yl]acetamide Formula: C22H20N4O2S2 MolecularWeight: 436.5498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC4=CSC(=N4)NC(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC4=CSC(=N4)NC(=O)C

InChI

InChI=1S/C22H20N4O2S2/c1-13-7-6-8-14(2)19(13)26-20(28)17-9-4-5-10-18(17)25-22(26)30-12-16-11-29-21(24-16)23-15(3)27/h4-11H,12H2,1-3H3,(H,23,24,27)