3-[(3,4-diethoxyphenyl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(3,4-diethoxyphenyl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-[(3,4-diethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3,4-diethoxyphenyl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3,4-diethoxyphenyl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-(3,4-diethoxybenzyl)-1H-1,2,4-triazole-5-thione Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC2=NNC(=S)N2CC=C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC2=NNC(=S)N2CC=C)OCC

InChI

InChI=1S/C16H21N3O2S/c1-4-9-19-15(17-18-16(19)22)11-12-7-8-13(20-5-2)14(10-12)21-6-3/h4,7-8,10H,1,5-6,9,11H2,2-3H3,(H,18,22)