methyl 3-[(5-chloranyl-2-methyl-phenyl)carbamothioylsulfanyl]propanoate

Systemtic Name: methyl 3-[(5-chloranyl-2-methyl-phenyl)carbamothioylsulfanyl]propanoate Openeye Name: methyl 3-[(5-chloro-2-methyl-phenyl)carbamothioylsulfanyl]propanoate CAS Name: 3-[[(5-chloro-2-methylanilino)-sulfanylidenemethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(5-chloro-2-methylphenyl)carbamothioylsulfanyl]propanoate Traditional Name: 3-[(5-chloro-2-methyl-phenyl)thiocarbamoylthio]propionic acid methyl ester Formula: C12H14ClNO2S2 MolecularWeight: 303.82806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=S)SCCC(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=S)SCCC(=O)OC

InChI

InChI=1S/C12H14ClNO2S2/c1-8-3-4-9(13)7-10(8)14-12(17)18-6-5-11(15)16-2/h3-4,7H,5-6H2,1-2H3,(H,14,17)