N-[(1-methylbenzimidazol-2-yl)methyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-[(1-methylbenzimidazol-2-yl)methyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-[(1-methylbenzimidazol-2-yl)methyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-[(1-methyl-2-benzimidazolyl)methyl]-4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-[(1-methylbenzimidazol-2-yl)methyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-[(1-methylbenzimidazol-2-yl)methyl]-4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzamide Formula: C22H22N6O2S MolecularWeight: 434.51408

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCC3=NC4=CC=CC=C4N3C

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C22H22N6O2S/c1-27-12-11-23-22(27)31-14-20(29)25-16-9-7-15(8-10-16)21(30)24-13-19-26-17-5-3-4-6-18(17)28(19)2/h3-12H,13-14H2,1-2H3,(H,24,30)(H,25,29)