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

Systemtic Name: N-[4-(1-benzofuran-2-yl)phenyl]-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[4-(benzofuran-2-yl)phenyl]-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[4-(2-benzofuranyl)phenyl]-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[4-(1-benzofuran-2-yl)phenyl]-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[4-(benzofuran-2-yl)phenyl]-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SCC(=O)NC3=CC=C(C=C3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SCC(=O)NC3=CC=C(C=C3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C25H26N4O2S/c1-17-27-28-25(29(17)21-8-3-2-4-9-21)32-16-24(30)26-20-13-11-18(12-14-20)23-15-19-7-5-6-10-22(19)31-23/h5-7,10-15,21H,2-4,8-9,16H2,1H3,(H,26,30)