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

Systemtic Name: 2-[[5-(1,3-benzodioxol-5-ylmethyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-ethanamide Openeye Name: 2-[[5-(1,3-benzodioxol-5-ylmethyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-acetamide CAS Name: 2-[[5-(1,3-benzodioxol-5-ylmethyl)-4-cyclohexyl-1,2,4-triazol-3-yl]thio]-N-cyclopentylacetamide IUPAC Name: 2-[[5-(1,3-benzodioxol-5-ylmethyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentylacetamide Traditional Name: 2-[(4-cyclohexyl-5-piperonyl-1,2,4-triazol-3-yl)thio]-N-cyclopentyl-acetamide Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC(=O)NC3CCCC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC(=O)NC3CCCC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H30N4O3S/c28-22(24-17-6-4-5-7-17)14-31-23-26-25-21(27(23)18-8-2-1-3-9-18)13-16-10-11-19-20(12-16)30-15-29-19/h10-12,17-18H,1-9,13-15H2,(H,24,28)