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

Systemtic Name: 2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole-3-thione Openeye Name: 2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]-5-(2-furyl)-4-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-(2-ethoxyphenyl)-1-piperazinyl]methyl]-5-(2-furanyl)-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-(2-ethoxyphenyl)piperazin-1-yl]methyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole-3-thione Traditional Name: 5-(2-furyl)-4-methyl-2-[(4-o-phenetylpiperazino)methyl]-1,2,4-triazole-3-thione Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)CN3C(=S)N(C(=N3)C4=CC=CO4)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)CN3C(=S)N(C(=N3)C4=CC=CO4)C

InChI

InChI=1S/C20H25N5O2S/c1-3-26-17-8-5-4-7-16(17)24-12-10-23(11-13-24)15-25-20(28)22(2)19(21-25)18-9-6-14-27-18/h4-9,14H,3,10-13,15H2,1-2H3