3-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 3-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 3-[[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 3-[[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 3-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 3-[[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,3,4-thiadiazole-2-thione Formula: C17H19N4O2S3+ MolecularWeight: 407.55336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=S)SC=N2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=S)SC=N2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C17H18N4O2S3/c22-26(23,16-6-5-14-3-1-2-4-15(14)11-16)20-9-7-19(8-10-20)13-21-17(24)25-12-18-21/h1-6,11-12H,7-10,13H2/p+1