O-butyl [2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate

Systemtic Name: O-butyl [2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethanethioate Openeye Name: O-butyl [2-(4-chloroanilino)-2-oxo-ethyl]sulfanylmethanethioate CAS Name: [[2-(4-chloroanilino)-2-oxoethyl]thio]methanethioic acid O-butyl ester IUPAC Name: O-butyl [2-(4-chloroanilino)-2-oxoethyl]sulfanylmethanethioate Traditional Name: [[2-(4-chloroanilino)-2-keto-ethyl]thio]methanethioic acid O-butyl ester Formula: C13H16ClNO2S2 MolecularWeight: 317.85464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=S)SCC(=O)NC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCOC(=S)SCC(=O)NC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H16ClNO2S2/c1-2-3-8-17-13(18)19-9-12(16)15-11-6-4-10(14)5-7-11/h4-7H,2-3,8-9H2,1H3,(H,15,16)