N-cyclohexyl-2-[[5-(4-decoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-cyclohexyl-2-[[5-(4-decoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(4-decoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-acetamide CAS Name: N-cyclohexyl-2-[[5-(4-decoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[[5-(4-decoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(4-decoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-acetamide Formula: C29H44N4O2S MolecularWeight: 512.75026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3CCCCC3

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3CCCCC3

InChI

InChI=1S/C29H44N4O2S/c1-3-5-6-7-8-9-10-14-22-35-26-19-17-24(18-20-26)28-31-32-29(33(28)21-4-2)36-23-27(34)30-25-15-12-11-13-16-25/h4,17-20,25H,2-3,5-16,21-23H2,1H3,(H,30,34)