2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-(2-phenylpropyl)benzamide

Systemtic Name: 2-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-(2-phenylpropyl)benzamide Openeye Name: 2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-(2-phenylpropyl)benzamide CAS Name: 2-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]-N-(2-phenylpropyl)benzamide IUPAC Name: 2-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-(2-phenylpropyl)benzamide Traditional Name: 2-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]-N-(2-phenylpropyl)benzamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC=CC=C1NC(=O)CSC2=NC=CN2C)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)C1=CC=CC=C1NC(=O)CSC2=NC=CN2C)C3=CC=CC=C3

InChI

InChI=1S/C22H24N4O2S/c1-16(17-8-4-3-5-9-17)14-24-21(28)18-10-6-7-11-19(18)25-20(27)15-29-22-23-12-13-26(22)2/h3-13,16H,14-15H2,1-2H3,(H,24,28)(H,25,27)