2-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]-N-phenethyl-benzamide

Systemtic Name: 2-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]-N-phenethyl-benzamide Openeye Name: 2-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]-N-phenethyl-benzamide CAS Name: 2-[[3-[(3,4-dimethylphenyl)thio]-1-oxopropyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[3-(3,4-dimethylphenyl)sulfanylpropanoylamino]-N-phenethylbenzamide Traditional Name: 2-[3-[(3,4-dimethylphenyl)thio]propanoylamino]-N-phenethyl-benzamide Formula: C26H28N2O2S MolecularWeight: 432.57772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C26H28N2O2S/c1-19-12-13-22(18-20(19)2)31-17-15-25(29)28-24-11-7-6-10-23(24)26(30)27-16-14-21-8-4-3-5-9-21/h3-13,18H,14-17H2,1-2H3,(H,27,30)(H,28,29)