5-(furan-2-yl)-2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 5-(furan-2-yl)-2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-5-(2-furyl)-2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 5-(2-furanyl)-2-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 5-(furan-2-yl)-2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-(2-furyl)-2-[[4-(2-methoxyphenyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CN3C(=S)N(C(=N3)C4=CC=CO4)CC=C

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CN3C(=S)N(C(=N3)C4=CC=CO4)CC=C

InChI

InChI=1S/C21H25N5O2S/c1-3-10-25-20(19-9-6-15-28-19)22-26(21(25)29)16-23-11-13-24(14-12-23)17-7-4-5-8-18(17)27-2/h3-9,15H,1,10-14,16H2,2H3