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

Systemtic Name: 4-chloranyl-N-[3-(furan-2-ylmethyl)-4-oxidanylidene-6-thiophen-3-yl-thieno[3,2-d]pyrimidin-2-yl]-5-methyl-2-sulfanyl-benzenesulfonamide Openeye Name: 4-chloro-N-[3-(2-furylmethyl)-4-oxo-6-(3-thienyl)thieno[3,2-d]pyrimidin-2-yl]-5-methyl-2-sulfanyl-benzenesulfonamide CAS Name: 4-chloro-N-[3-(2-furanylmethyl)-4-oxo-6-(3-thiophenyl)-2-thieno[3,2-d]pyrimidinyl]-2-mercapto-5-methylbenzenesulfonamide IUPAC Name: 4-chloro-N-[3-(furan-2-ylmethyl)-4-oxo-6-thiophen-3-ylthieno[3,2-d]pyrimidin-2-yl]-5-methyl-2-sulfanylbenzenesulfonamide Traditional Name: 4-chloro-N-[3-(2-furfuryl)-4-keto-6-(3-thienyl)thieno[3,2-d]pyrimidin-2-yl]-2-mercapto-5-methyl-benzenesulfonamide Formula: C22H16ClN3O4S4 MolecularWeight: 550.09314

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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)C5=CSC=C5

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC3=C(C(=O)N2CC4=CC=CO4)SC(=C3)C5=CSC=C5

InChI

InChI=1S/C22H16ClN3O4S4/c1-12-7-19(17(31)8-15(12)23)34(28,29)25-22-24-16-9-18(13-4-6-32-11-13)33-20(16)21(27)26(22)10-14-3-2-5-30-14/h2-9,11,31H,10H2,1H3,(H,24,25)