2-[[5-cyclohexyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[[5-cyclohexyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[(4-benzyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-furylmethyl)acetamide CAS Name: 2-[[5-cyclohexyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[(4-benzyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[(4-benzyl-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-(2-furfuryl)acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H26N4O2S/c27-20(23-14-19-12-7-13-28-19)16-29-22-25-24-21(18-10-5-2-6-11-18)26(22)15-17-8-3-1-4-9-17/h1,3-4,7-9,12-13,18H,2,5-6,10-11,14-16H2,(H,23,27)