3-[[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]thio]methyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]thio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)S(=O)(=O)N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)S(=O)(=O)N(C)C

InChI

InChI=1S/C25H25N3O3S2/c1-4-18-12-14-20(15-13-18)28-24(29)22-10-5-6-11-23(22)26-25(28)32-17-19-8-7-9-21(16-19)33(30,31)27(2)3/h5-16H,4,17H2,1-3H3