4-chloranyl-5-methyl-N-[4-oxidanylidene-6-phenyl-3-(phenylmethyl)thieno[3,2-d]pyrimidin-2-yl]-2-sulfanyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-5-methyl-N-[4-oxidanylidene-6-phenyl-3-(phenylmethyl)thieno[3,2-d]pyrimidin-2-yl]-2-sulfanyl-benzenesulfonamide Openeye Name: N-(3-benzyl-4-oxo-6-phenyl-thieno[3,2-d]pyrimidin-2-yl)-4-chloro-5-methyl-2-sulfanyl-benzenesulfonamide CAS Name: 4-chloro-2-mercapto-5-methyl-N-[4-oxo-6-phenyl-3-(phenylmethyl)-2-thieno[3,2-d]pyrimidinyl]benzenesulfonamide IUPAC Name: N-(3-benzyl-4-oxo-6-phenylthieno[3,2-d]pyrimidin-2-yl)-4-chloro-5-methyl-2-sulfanylbenzenesulfonamide Traditional Name: N-(3-benzyl-4-keto-6-phenyl-thieno[3,2-d]pyrimidin-2-yl)-4-chloro-2-mercapto-5-methyl-benzenesulfonamide Formula: C26H20ClN3O3S3 MolecularWeight: 554.1033

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC3=C(C(=O)N2CC4=CC=CC=C4)SC(=C3)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC3=C(C(=O)N2CC4=CC=CC=C4)SC(=C3)C5=CC=CC=C5

InChI

InChI=1S/C26H20ClN3O3S3/c1-16-12-23(21(34)13-19(16)27)36(32,33)29-26-28-20-14-22(18-10-6-3-7-11-18)35-24(20)25(31)30(26)15-17-8-4-2-5-9-17/h2-14,34H,15H2,1H3,(H,28,29)