S-butyl N-(4-chloranyl-2-methyl-phenyl)carbamothioate

Systemtic Name: S-butyl N-(4-chloranyl-2-methyl-phenyl)carbamothioate Openeye Name: S-butyl N-(4-chloro-2-methyl-phenyl)carbamothioate CAS Name: N-(4-chloro-2-methylphenyl)carbamothioic acid S-butyl ester IUPAC Name: S-butyl N-(4-chloro-2-methylphenyl)carbamothioate Traditional Name: N-(4-chloro-2-methyl-phenyl)thiocarbamic acid S-butyl ester Formula: C12H16ClNOS MolecularWeight: 257.77954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=O)NC1=C(C=C(C=C1)Cl)C

Isomeric SMILES

CCCCSC(=O)NC1=C(C=C(C=C1)Cl)C

InChI

InChI=1S/C12H16ClNOS/c1-3-4-7-16-12(15)14-11-6-5-10(13)8-9(11)2/h5-6,8H,3-4,7H2,1-2H3,(H,14,15)