3-(4-decoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(4-decoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-(4-decoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(4-decoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(4-decoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-(4-decoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C21H31N3OS MolecularWeight: 373.55534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=NNC(=S)N2CC=C

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=NNC(=S)N2CC=C

InChI

InChI=1S/C21H31N3OS/c1-3-5-6-7-8-9-10-11-17-25-19-14-12-18(13-15-19)20-22-23-21(26)24(20)16-4-2/h4,12-15H,2-3,5-11,16-17H2,1H3,(H,23,26)