4-[[3-(3,4-dimethylphenyl)sulfanylpropanoyl-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[3-(3,4-dimethylphenyl)sulfanylpropanoyl-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[3-(3,4-dimethylphenyl)sulfanylpropanoyl-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[3-[(3,4-dimethylphenyl)thio]-1-oxopropyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[3-(3,4-dimethylphenyl)sulfanylpropanoyl-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[3-[(3,4-dimethylphenyl)thio]propanoyl-methyl-amino]methyl]-N-methyl-benzamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)N(C)CC2=CC=C(C=C2)C(=O)NC)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)N(C)CC2=CC=C(C=C2)C(=O)NC)C

InChI

InChI=1S/C21H26N2O2S/c1-15-5-10-19(13-16(15)2)26-12-11-20(24)23(4)14-17-6-8-18(9-7-17)21(25)22-3/h5-10,13H,11-12,14H2,1-4H3,(H,22,25)