methyl N'-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonyl]-N-(4-chlorophenyl)carbamimidothioate

Systemtic Name: methyl N'-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonyl]-N-(4-chlorophenyl)carbamimidothioate Openeye Name: 3-(5-chloro-3-methyl-benzothiophen-2-yl)sulfonyl-1-(4-chlorophenyl)-2-methyl-isothiourea CAS Name: N'-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonyl]-N-(4-chlorophenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonyl]-N-(4-chlorophenyl)carbamimidothioate Traditional Name: 3-(5-chloro-3-methyl-benzothiophen-2-yl)sulfonyl-1-(4-chlorophenyl)-2-methyl-isothiourea Formula: C17H14Cl2N2O2S3 MolecularWeight: 445.40626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)N=C(NC3=CC=C(C=C3)Cl)SC

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)/N=C(/NC3=CC=C(C=C3)Cl)\SC

InChI

InChI=1S/C17H14Cl2N2O2S3/c1-10-14-9-12(19)5-8-15(14)25-16(10)26(22,23)21-17(24-2)20-13-6-3-11(18)4-7-13/h3-9H,1-2H3,(H,20,21)