N-[(5-methylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methyl]cyclohexanecarboxamide

Systemtic Name: N-[(5-methylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methyl]cyclohexanecarboxamide Openeye Name: N-[(4-allyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-[[5-(methylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]cyclohexanecarboxamide IUPAC Name: N-[(5-methylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methyl]cyclohexanecarboxamide Traditional Name: N-[[4-allyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]cyclohexanecarboxamide Formula: C14H22N4OS MolecularWeight: 294.41568

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC=C)CNC(=O)C2CCCCC2

Isomeric SMILES

CSC1=NN=C(N1CC=C)CNC(=O)C2CCCCC2

InChI

InChI=1S/C14H22N4OS/c1-3-9-18-12(16-17-14(18)20-2)10-15-13(19)11-7-5-4-6-8-11/h3,11H,1,4-10H2,2H3,(H,15,19)