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

Systemtic Name: 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole-3-thione Openeye Name: 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-5-(2-furyl)-4-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-(2-chlorophenyl)-1-piperazinyl]methyl]-5-(2-furanyl)-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole-3-thione Traditional Name: 2-[[4-(2-chlorophenyl)piperazino]methyl]-5-(2-furyl)-4-methyl-1,2,4-triazole-3-thione Formula: C18H20ClN5OS MolecularWeight: 389.9023

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=C3Cl)C4=CC=CO4

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=C3Cl)C4=CC=CO4

InChI

InChI=1S/C18H20ClN5OS/c1-21-17(16-7-4-12-25-16)20-24(18(21)26)13-22-8-10-23(11-9-22)15-6-3-2-5-14(15)19/h2-7,12H,8-11,13H2,1H3