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

Systemtic Name: 4-chloranyl-N-[3-(furan-2-ylmethyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]-5-methyl-2-sulfanyl-benzenesulfonamide Openeye Name: 4-chloro-N-[3-(2-furylmethyl)-4-oxo-thieno[3,2-d]pyrimidin-2-yl]-5-methyl-2-sulfanyl-benzenesulfonamide CAS Name: 4-chloro-N-[3-(2-furanylmethyl)-4-oxo-2-thieno[3,2-d]pyrimidinyl]-2-mercapto-5-methylbenzenesulfonamide IUPAC Name: 4-chloro-N-[3-(furan-2-ylmethyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]-5-methyl-2-sulfanylbenzenesulfonamide Traditional Name: 4-chloro-N-[3-(2-furfuryl)-4-keto-thieno[3,2-d]pyrimidin-2-yl]-2-mercapto-5-methyl-benzenesulfonamide Formula: C18H14ClN3O4S3 MolecularWeight: 467.96946

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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=CO4)SC=C3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC3=C(C(=O)N2CC4=CC=CO4)SC=C3

InChI

InChI=1S/C18H14ClN3O4S3/c1-10-7-15(14(27)8-12(10)19)29(24,25)21-18-20-13-4-6-28-16(13)17(23)22(18)9-11-3-2-5-26-11/h2-8,27H,9H2,1H3,(H,20,21)