3-(7-methyl-2-oxidanyl-octan-4-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(7-methyl-2-oxidanyl-octan-4-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-[1-(2-hydroxypropyl)-4-methyl-pentyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-(2-hydroxy-7-methyloctan-4-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2-hydroxy-7-methyloctan-4-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-[1-(2-hydroxypropyl)-4-methyl-pentyl]-1H-1,2,4-triazole-5-thione Formula: C14H25N3OS MolecularWeight: 283.4328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(CC(C)O)C1=NNC(=S)N1CC=C

Isomeric SMILES

CC(C)CCC(CC(C)O)C1=NNC(=S)N1CC=C

InChI

InChI=1S/C14H25N3OS/c1-5-8-17-13(15-16-14(17)19)12(9-11(4)18)7-6-10(2)3/h5,10-12,18H,1,6-9H2,2-4H3,(H,16,19)