methyl 2-[(2,6-dimethylphenyl)carbothioylamino]-3-(4-methylphenyl)propanoate

Systemtic Name: methyl 2-[(2,6-dimethylphenyl)carbothioylamino]-3-(4-methylphenyl)propanoate Openeye Name: methyl 2-[(2,6-dimethylbenzenecarbothioyl)amino]-3-(p-tolyl)propanoate CAS Name: 2-[[(2,6-dimethylphenyl)-sulfanylidenemethyl]amino]-3-(4-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(2,6-dimethylbenzenecarbothioyl)amino]-3-(4-methylphenyl)propanoate Traditional Name: 2-[(2,6-dimethylthiobenzoyl)amino]-3-(p-tolyl)propionic acid methyl ester Formula: C20H23NO2S MolecularWeight: 341.46712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C(=O)OC)NC(=S)C2=C(C=CC=C2C)C

Isomeric SMILES

CC1=CC=C(C=C1)CC(C(=O)OC)NC(=S)C2=C(C=CC=C2C)C

InChI

InChI=1S/C20H23NO2S/c1-13-8-10-16(11-9-13)12-17(20(22)23-4)21-19(24)18-14(2)6-5-7-15(18)3/h5-11,17H,12H2,1-4H3,(H,21,24)