N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-(1-benzylimidazol-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(2-furylmethyl)acetamide CAS Name: N-(2-cyanoethyl)-N-(2-furanylmethyl)-2-[[1-(phenylmethyl)-2-imidazolyl]thio]acetamide IUPAC Name: 2-(1-benzylimidazol-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[(1-benzylimidazol-2-yl)thio]-N-(2-cyanoethyl)-N-(2-furfuryl)acetamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CN=C2SCC(=O)N(CCC#N)CC3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CN=C2SCC(=O)N(CCC#N)CC3=CC=CO3

InChI

InChI=1S/C20H20N4O2S/c21-9-5-11-23(15-18-8-4-13-26-18)19(25)16-27-20-22-10-12-24(20)14-17-6-2-1-3-7-17/h1-4,6-8,10,12-13H,5,11,14-16H2