2-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-2-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-1,2,4-triazole-3-thione CAS Name: 2-[[(3,4-dimethoxyphenyl)methyl-methylamino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(3,4-dimethoxyphenyl)methyl-methylamino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-2-[[methyl(veratryl)amino]methyl]-1,2,4-triazole-3-thione Formula: C16H22N4O2S MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)CN2C(=S)N(C=N2)CC=C

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)CN2C(=S)N(C=N2)CC=C

InChI

InChI=1S/C16H22N4O2S/c1-5-8-19-11-17-20(16(19)23)12-18(2)10-13-6-7-14(21-3)15(9-13)22-4/h5-7,9,11H,1,8,10,12H2,2-4H3