S-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2-azanylbenzenecarbothioate

Systemtic Name: S-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2-azanylbenzenecarbothioate Openeye Name: S-[2-(3,4-dimethylphenyl)-2-oxo-ethyl] 2-aminobenzenecarbothioate CAS Name: 2-aminobenzenecarbothioic acid S-[2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: S-[2-(3,4-dimethylphenyl)-2-oxoethyl] 2-aminobenzenecarbothioate Traditional Name: 2-aminothiobenzoic acid S-[2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CSC(=O)C2=CC=CC=C2N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CSC(=O)C2=CC=CC=C2N)C

InChI

InChI=1S/C17H17NO2S/c1-11-7-8-13(9-12(11)2)16(19)10-21-17(20)14-5-3-4-6-15(14)18/h3-9H,10,18H2,1-2H3