2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyano-1-benzofuran-3-yl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyano-1-benzofuran-3-yl)ethanamide Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyanobenzofuran-3-yl)acetamide CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-(2-cyano-3-benzofuranyl)acetamide IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-cyano-1-benzofuran-3-yl)acetamide Traditional Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-(2-cyanobenzofuran-3-yl)acetamide Formula: C19H20N6O2S MolecularWeight: 396.4661

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N)SCC(=O)NC3=C(OC4=CC=CC=C43)C#N

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2N)SCC(=O)NC3=C(OC4=CC=CC=C43)C#N

InChI

InChI=1S/C19H20N6O2S/c20-10-15-17(13-8-4-5-9-14(13)27-15)22-16(26)11-28-19-24-23-18(25(19)21)12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,11,21H2,(H,22,26)