methyl N'-[[3-[(4-chlorophenyl)sulfanylmethyl]thiophen-2-yl]methyl]-N-cyano-carbamimidothioate

Systemtic Name: methyl N'-[[3-[(4-chlorophenyl)sulfanylmethyl]thiophen-2-yl]methyl]-N-cyano-carbamimidothioate Openeye Name: 3-[[3-[(4-chlorophenyl)sulfanylmethyl]-2-thienyl]methyl]-1-cyano-2-methyl-isothiourea CAS Name: N'-[[3-[[(4-chlorophenyl)thio]methyl]-2-thiophenyl]methyl]-N-cyanocarbamimidothioic acid methyl ester IUPAC Name: methyl N'-[[3-[(4-chlorophenyl)sulfanylmethyl]thiophen-2-yl]methyl]-N-cyanocarbamimidothioate Traditional Name: 3-[[3-[[(4-chlorophenyl)thio]methyl]-2-thienyl]methyl]-1-cyano-2-methyl-isothiourea Formula: C15H14ClN3S3 MolecularWeight: 367.93976

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCC1=C(C=CS1)CSC2=CC=C(C=C2)Cl)NC#N

Isomeric SMILES

CSC(=NCC1=C(C=CS1)CSC2=CC=C(C=C2)Cl)NC#N

InChI

InChI=1S/C15H14ClN3S3/c1-20-15(19-10-17)18-8-14-11(6-7-21-14)9-22-13-4-2-12(16)3-5-13/h2-7H,8-9H2,1H3,(H,18,19)