2-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methyl]-5-cyclopropyl-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methyl]-5-cyclopropyl-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-2-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methyl]-5-cyclopropyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]methyl]-5-cyclopropyl-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methyl]-5-cyclopropyl-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-cyclopropyl-2-[(4-piazthiol-4-ylsulfonylpiperazino)methyl]-1,2,4-triazole-3-thione Formula: C19H23N7O2S3 MolecularWeight: 477.62662

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN(C1=S)CN2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43)C5CC5

Isomeric SMILES

C=CCN1C(=NN(C1=S)CN2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43)C5CC5

InChI

InChI=1S/C19H23N7O2S3/c1-2-8-25-18(14-6-7-14)20-26(19(25)29)13-23-9-11-24(12-10-23)31(27,28)16-5-3-4-15-17(16)22-30-21-15/h2-5,14H,1,6-13H2