S-(phenylmethyl) N-(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioate

Systemtic Name: S-(phenylmethyl) N-(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioate Openeye Name: S-benzyl N-(5-chloro-2,4-dimethoxy-phenyl)carbamothioate CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)carbamothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl N-(5-chloro-2,4-dimethoxyphenyl)carbamothioate Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)thiocarbamic acid S-benzyl ester Formula: C16H16ClNO3S MolecularWeight: 337.82114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)SCC2=CC=CC=C2)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)SCC2=CC=CC=C2)Cl)OC

InChI

InChI=1S/C16H16ClNO3S/c1-20-14-9-15(21-2)13(8-12(14)17)18-16(19)22-10-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3,(H,18,19)