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

Systemtic Name: 5-cyclopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-5-cyclopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 5-cyclopropyl-2-[(4-phenyl-1-piperazin-1-iumyl)methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 5-cyclopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-cyclopropyl-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,2,4-triazole-3-thione Formula: C19H26N5S+ MolecularWeight: 356.50824

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN(C1=S)C[NH+]2CCN(CC2)C3=CC=CC=C3)C4CC4

Isomeric SMILES

C=CCN1C(=NN(C1=S)C[NH+]2CCN(CC2)C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C19H25N5S/c1-2-10-23-18(16-8-9-16)20-24(19(23)25)15-21-11-13-22(14-12-21)17-6-4-3-5-7-17/h2-7,16H,1,8-15H2/p+1