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

Systemtic Name: 5-(4-methoxyphenyl)-4-prop-2-enyl-2-[(4-pyridin-4-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-allyl-5-(4-methoxyphenyl)-2-[[4-(4-pyridyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 5-(4-methoxyphenyl)-4-prop-2-enyl-2-[(4-pyridin-4-yl-1-piperazinyl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 5-(4-methoxyphenyl)-4-prop-2-enyl-2-[(4-pyridin-4-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-(4-methoxyphenyl)-2-[[4-(4-pyridyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C22H26N6OS MolecularWeight: 422.54644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=S)N2CC=C)CN3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=S)N2CC=C)CN3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C22H26N6OS/c1-3-12-27-21(18-4-6-20(29-2)7-5-18)24-28(22(27)30)17-25-13-15-26(16-14-25)19-8-10-23-11-9-19/h3-11H,1,12-17H2,2H3