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

Systemtic Name: N-cyclopentyl-2-[[4-(furan-2-ylmethyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-benzyl-4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-acetamide CAS Name: N-cyclopentyl-2-[[4-(2-furanylmethyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-benzyl-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentylacetamide Traditional Name: 2-[[5-benzyl-4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]-N-cyclopentyl-acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N4O2S/c26-20(22-17-9-4-5-10-17)15-28-21-24-23-19(13-16-7-2-1-3-8-16)25(21)14-18-11-6-12-27-18/h1-3,6-8,11-12,17H,4-5,9-10,13-15H2,(H,22,26)