3-cyclohexylsulfanyl-5-methyl-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-cyclohexylsulfanyl-5-methyl-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-cyclohexylsulfanyl-5-methyl-1,2,4-triazole CAS Name: 3-(cyclohexylthio)-5-methyl-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-cyclohexylsulfanyl-5-methyl-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(cyclohexylthio)-5-methyl-1,2,4-triazole Formula: C12H19N3S MolecularWeight: 237.36436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SC2CCCCC2

Isomeric SMILES

CC1=NN=C(N1CC=C)SC2CCCCC2

InChI

InChI=1S/C12H19N3S/c1-3-9-15-10(2)13-14-12(15)16-11-7-5-4-6-8-11/h3,11H,1,4-9H2,2H3