N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(2-cyanoethyl)-N-(2-furylmethyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide CAS Name: N-(2-cyanoethyl)-N-(2-furanylmethyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide Traditional Name: N-(2-cyanoethyl)-N-(2-furfuryl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]acetamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCC(=O)N(CCC#N)CC3=CC=CO3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCC(=O)N(CCC#N)CC3=CC=CO3

InChI

InChI=1S/C18H18N4O3S/c1-24-13-5-6-15-16(10-13)21-18(20-15)26-12-17(23)22(8-3-7-19)11-14-4-2-9-25-14/h2,4-6,9-10H,3,8,11-12H2,1H3,(H,20,21)