5-[2-(1-phenethylbenzimidazol-2-yl)sulfanylethanoylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[2-(1-phenethylbenzimidazol-2-yl)sulfanylethanoylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[[2-(1-phenethylbenzimidazol-2-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxamide CAS Name: 5-[[1-oxo-2-[(1-phenethyl-2-benzimidazolyl)thio]ethyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[[2-(1-phenethylbenzimidazol-2-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxamide Traditional Name: 5-[[2-[(1-phenethylbenzimidazol-2-yl)thio]acetyl]amino]isophthalamide Formula: C25H23N5O3S MolecularWeight: 473.54682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC(=C4)C(=O)N)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC(=C4)C(=O)N)C(=O)N

InChI

InChI=1S/C25H23N5O3S/c26-23(32)17-12-18(24(27)33)14-19(13-17)28-22(31)15-34-25-29-20-8-4-5-9-21(20)30(25)11-10-16-6-2-1-3-7-16/h1-9,12-14H,10-11,15H2,(H2,26,32)(H2,27,33)(H,28,31)