N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)-2-[1-(oxolan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)-2-[1-(oxolan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)-2-[5-phenyl-1-(tetrahydrofuran-2-ylmethyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)-2-[[1-(2-oxolanylmethyl)-5-phenyl-2-imidazolyl]thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)-2-[1-(oxolan-2-ylmethyl)-5-phenylimidazol-2-yl]sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-(3,4-dimethylphenyl)-2-[[5-phenyl-1-(tetrahydrofurfuryl)imidazol-2-yl]thio]acetamide Formula: C27H30N4O2S MolecularWeight: 474.6177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CCC#N)C(=O)CSC2=NC=C(N2CC3CCCO3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CCC#N)C(=O)CSC2=NC=C(N2CC3CCCO3)C4=CC=CC=C4)C

InChI

InChI=1S/C27H30N4O2S/c1-20-11-12-23(16-21(20)2)30(14-7-13-28)26(32)19-34-27-29-17-25(22-8-4-3-5-9-22)31(27)18-24-10-6-15-33-24/h3-5,8-9,11-12,16-17,24H,6-7,10,14-15,18-19H2,1-2H3