methyl N-(4-chlorophenyl)-N'-(5-pyridin-2-ylthiophen-2-yl)sulfonyl-carbamimidothioate

Systemtic Name: methyl N-(4-chlorophenyl)-N'-(5-pyridin-2-ylthiophen-2-yl)sulfonyl-carbamimidothioate Openeye Name: 1-(4-chlorophenyl)-2-methyl-3-[[5-(2-pyridyl)-2-thienyl]sulfonyl]isothiourea CAS Name: N-(4-chlorophenyl)-N'-[[5-(2-pyridinyl)-2-thiophenyl]sulfonyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N-(4-chlorophenyl)-N'-(5-pyridin-2-ylthiophen-2-yl)sulfonylcarbamimidothioate Traditional Name: 1-(4-chlorophenyl)-2-methyl-3-[[5-(2-pyridyl)-2-thienyl]sulfonyl]isothiourea Formula: C17H14ClN3O2S3 MolecularWeight: 423.95996

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NS(=O)(=O)C1=CC=C(S1)C2=CC=CC=N2)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CS/C(=N\S(=O)(=O)C1=CC=C(S1)C2=CC=CC=N2)/NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN3O2S3/c1-24-17(20-13-7-5-12(18)6-8-13)21-26(22,23)16-10-9-15(25-16)14-4-2-3-11-19-14/h2-11H,1H3,(H,20,21)