3-[2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylethanoyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylethanoyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[benzyl-[2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]amino]propanamide CAS Name: 3-[[2-[[1-(2,4-dimethylphenyl)-2-imidazolyl]thio]-1-oxoethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]amino]propanamide Traditional Name: 3-[benzyl-[2-[[1-(2,4-dimethylphenyl)imidazol-2-yl]thio]acetyl]amino]propionamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CN=C2SCC(=O)N(CCC(=O)N)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CN=C2SCC(=O)N(CCC(=O)N)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H26N4O2S/c1-17-8-9-20(18(2)14-17)27-13-11-25-23(27)30-16-22(29)26(12-10-21(24)28)15-19-6-4-3-5-7-19/h3-9,11,13-14H,10,12,15-16H2,1-2H3,(H2,24,28)