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

Systemtic Name: 5-(2,4-dichlorophenyl)-2-[(4-phenylpiperazin-1-yl)methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-5-(2,4-dichlorophenyl)-2-[(4-phenylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 5-(2,4-dichlorophenyl)-2-[(4-phenyl-1-piperazinyl)methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 5-(2,4-dichlorophenyl)-2-[(4-phenylpiperazin-1-yl)methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-(2,4-dichlorophenyl)-2-[(4-phenylpiperazino)methyl]-1,2,4-triazole-3-thione Formula: C22H23Cl2N5S MolecularWeight: 460.42252

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=C3)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C=CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=C3)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H23Cl2N5S/c1-2-10-28-21(19-9-8-17(23)15-20(19)24)25-29(22(28)30)16-26-11-13-27(14-12-26)18-6-4-3-5-7-18/h2-9,15H,1,10-14,16H2