4-methoxy-N-[(4-methylphenyl)sulfonylmethyl]benzenecarbothioamide

Systemtic Name: 4-methoxy-N-[(4-methylphenyl)sulfonylmethyl]benzenecarbothioamide Openeye Name: 4-methoxy-N-(p-tolylsulfonylmethyl)benzenecarbothioamide CAS Name: 4-methoxy-N-[(4-methylphenyl)sulfonylmethyl]benzenecarbothioamide IUPAC Name: 4-methoxy-N-[(4-methylphenyl)sulfonylmethyl]benzenecarbothioamide Traditional Name: 4-methoxy-N-(tosylmethyl)thiobenzamide Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CNC(=S)C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CNC(=S)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H17NO3S2/c1-12-3-9-15(10-4-12)22(18,19)11-17-16(21)13-5-7-14(20-2)8-6-13/h3-10H,11H2,1-2H3,(H,17,21)