N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-[2-(2-methoxy-5-methylphenyl)ethyl]-4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-[2-(2-methoxy-5-methylphenyl)ethyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CCNC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CN3C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CCNC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CN3C

InChI

InChI=1S/C23H26N4O3S/c1-16-4-9-20(30-3)18(14-16)10-11-24-22(29)17-5-7-19(8-6-17)26-21(28)15-31-23-25-12-13-27(23)2/h4-9,12-14H,10-11,15H2,1-3H3,(H,24,29)(H,26,28)