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

Systemtic Name: 2-[[5-[(4-chloranyl-2-methyl-phenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-ethanamide Openeye Name: 2-[[4-allyl-5-[(4-chloro-2-methyl-phenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-acetamide CAS Name: 2-[[5-[(4-chloro-2-methylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-cyclohexylacetamide IUPAC Name: 2-[[5-[(4-chloro-2-methylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexylacetamide Traditional Name: 2-[[4-allyl-5-[(4-chloro-2-methyl-phenoxy)methyl]-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-acetamide Formula: C21H27ClN4O2S MolecularWeight: 434.98268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC2=NN=C(N2CC=C)SCC(=O)NC3CCCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC2=NN=C(N2CC=C)SCC(=O)NC3CCCCC3

InChI

InChI=1S/C21H27ClN4O2S/c1-3-11-26-19(13-28-18-10-9-16(22)12-15(18)2)24-25-21(26)29-14-20(27)23-17-7-5-4-6-8-17/h3,9-10,12,17H,1,4-8,11,13-14H2,2H3,(H,23,27)