N-methyl-4-[[methyl-[4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]phenyl]carbonyl-amino]methyl]benzamide

Systemtic Name: N-methyl-4-[[methyl-[4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]phenyl]carbonyl-amino]methyl]benzamide Openeye Name: N-methyl-4-[[methyl-[4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzoyl]amino]methyl]benzamide CAS Name: N-methyl-4-[[methyl-[[4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]phenyl]-oxomethyl]amino]methyl]benzamide IUPAC Name: N-methyl-4-[[methyl-[4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzoyl]amino]methyl]benzamide Traditional Name: N-methyl-4-[[methyl-[4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzoyl]amino]methyl]benzamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(C)C(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CN3C

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(C)C(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CN3C

InChI

InChI=1S/C23H25N5O3S/c1-24-21(30)17-6-4-16(5-7-17)14-28(3)22(31)18-8-10-19(11-9-18)26-20(29)15-32-23-25-12-13-27(23)2/h4-13H,14-15H2,1-3H3,(H,24,30)(H,26,29)