3,5-bis(chloranyl)-N-[4-(4-methoxypyridin-2-yl)-3-(phenylmethylsulfanyl)-1H-pyrazol-5-yl]thiophene-2-sulfonamide

Systemtic Name: 3,5-bis(chloranyl)-N-[4-(4-methoxypyridin-2-yl)-3-(phenylmethylsulfanyl)-1H-pyrazol-5-yl]thiophene-2-sulfonamide Openeye Name: N-[3-benzylsulfanyl-4-(4-methoxy-2-pyridyl)-1H-pyrazol-5-yl]-3,5-dichloro-thiophene-2-sulfonamide CAS Name: 3,5-dichloro-N-[4-(4-methoxy-2-pyridinyl)-3-(phenylmethylthio)-1H-pyrazol-5-yl]-2-thiophenesulfonamide IUPAC Name: N-[3-benzylsulfanyl-4-(4-methoxypyridin-2-yl)-1H-pyrazol-5-yl]-3,5-dichlorothiophene-2-sulfonamide Traditional Name: N-[3-(benzylthio)-4-(4-methoxy-2-pyridyl)-1H-pyrazol-5-yl]-3,5-dichloro-thiophene-2-sulfonamide Formula: C20H16Cl2N4O3S3 MolecularWeight: 527.46704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)C2=C(NN=C2SCC3=CC=CC=C3)NS(=O)(=O)C4=C(C=C(S4)Cl)Cl

Isomeric SMILES

COC1=CC(=NC=C1)C2=C(NN=C2SCC3=CC=CC=C3)NS(=O)(=O)C4=C(C=C(S4)Cl)Cl

InChI

InChI=1S/C20H16Cl2N4O3S3/c1-29-13-7-8-23-15(9-13)17-18(26-32(27,28)20-14(21)10-16(22)31-20)24-25-19(17)30-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,24,25,26)