3-[[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[(6-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[[6-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]methyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[6-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[(6-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C21H24ClN3O3S2 MolecularWeight: 466.01656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC3=CC(=CC=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC3=CC(=CC=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H24ClN3O3S2/c1-14(2)12-25-20(26)18-11-16(22)8-9-19(18)23-21(25)29-13-15-6-5-7-17(10-15)30(27,28)24(3)4/h5-11,14H,12-13H2,1-4H3