3-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 3-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 3-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 3-[[4-(3-bromophenyl)sulfonyl-1-piperazinyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 3-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 3-[[4-(3-bromophenyl)sulfonylpiperazino]methyl]-1,3,4-thiadiazole-2-thione Formula: C13H15BrN4O2S3 MolecularWeight: 435.3828

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=S)SC=N2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1CN2C(=S)SC=N2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C13H15BrN4O2S3/c14-11-2-1-3-12(8-11)23(19,20)17-6-4-16(5-7-17)10-18-13(21)22-9-15-18/h1-3,8-9H,4-7,10H2