N-cyclopentyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-cyclopentyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-cyclopentyl-2-[[4-isopentyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-cyclopentyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-cyclopentyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-cyclopentyl-2-[[4-isoamyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=NN=C1SCC(=O)NC2CCCC2)COC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN1C(=NN=C1SCC(=O)NC2CCCC2)COC3=CC=CC=C3

InChI

InChI=1S/C21H30N4O2S/c1-16(2)12-13-25-19(14-27-18-10-4-3-5-11-18)23-24-21(25)28-15-20(26)22-17-8-6-7-9-17/h3-5,10-11,16-17H,6-9,12-15H2,1-2H3,(H,22,26)