4-[2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylethanoylamino]benzamide

Systemtic Name: 4-[2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylethanoylamino]benzamide Openeye Name: 4-[[2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylacetyl]amino]benzamide CAS Name: 4-[[2-[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]acetyl]amino]benzamide Formula: C19H17N5O2S MolecularWeight: 379.43558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C19H17N5O2S/c20-10-3-11-24-16-5-2-1-4-15(16)23-19(24)27-12-17(25)22-14-8-6-13(7-9-14)18(21)26/h1-2,4-9H,3,11-12H2,(H2,21,26)(H,22,25)