5-[2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylethanoylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylethanoylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[[2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylacetyl]amino]benzene-1,3-dicarboxamide CAS Name: 5-[[2-[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]-1-oxoethyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[[2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylacetyl]amino]benzene-1,3-dicarboxamide Traditional Name: 5-[[2-[(1-p-phenetylbenzimidazol-2-yl)thio]acetyl]amino]isophthalamide Formula: C25H23N5O4S MolecularWeight: 489.54622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC(=C4)C(=O)N)C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC(=C4)C(=O)N)C(=O)N

InChI

InChI=1S/C25H23N5O4S/c1-2-34-19-9-7-18(8-10-19)30-21-6-4-3-5-20(21)29-25(30)35-14-22(31)28-17-12-15(23(26)32)11-16(13-17)24(27)33/h3-13H,2,14H2,1H3,(H2,26,32)(H2,27,33)(H,28,31)