4-cyclopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-cyclopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-5-(2-thienyl)-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-[(4-phenyl-1-piperazin-1-iumyl)methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-5-(2-thienyl)-1,2,4-triazole-3-thione Formula: C20H24N5S2+ MolecularWeight: 398.56806

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN(C2=S)C[NH+]3CCN(CC3)C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN(C2=S)C[NH+]3CCN(CC3)C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C20H23N5S2/c26-20-24(21-19(18-7-4-14-27-18)25(20)17-8-9-17)15-22-10-12-23(13-11-22)16-5-2-1-3-6-16/h1-7,14,17H,8-13,15H2/p+1