4-chloranyl-5-methyl-N-(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)-2-(phenylmethylsulfanyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-5-methyl-N-(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)-2-(phenylmethylsulfanyl)benzenesulfonamide Openeye Name: 2-benzylsulfanyl-4-chloro-5-methyl-N-(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)benzenesulfonamide CAS Name: 4-chloro-5-methyl-N-(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)-2-(phenylmethylthio)benzenesulfonamide IUPAC Name: 2-benzylsulfanyl-4-chloro-5-methyl-N-(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)benzenesulfonamide Traditional Name: 2-(benzylthio)-4-chloro-N-(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)-5-methyl-benzenesulfonamide Formula: C20H16ClN3O3S3 MolecularWeight: 478.00734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)SCC2=CC=CC=C2)S(=O)(=O)NC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)SCC2=CC=CC=C2)S(=O)(=O)NC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C20H16ClN3O3S3/c1-12-9-17(16(10-14(12)21)29-11-13-5-3-2-4-6-13)30(26,27)24-20-22-15-7-8-28-18(15)19(25)23-20/h2-10H,11H2,1H3,(H2,22,23,24,25)