[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2-thioxo-1H-pyridin-3-yl)methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Traditional Name: (4-brosylpiperazino)-(2-thioxo-1H-pyridin-3-yl)methanone Formula: C16H16BrN3O3S2 MolecularWeight: 442.35054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CNC2=S)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CNC2=S)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H16BrN3O3S2/c17-12-3-5-13(6-4-12)25(22,23)20-10-8-19(9-11-20)16(21)14-2-1-7-18-15(14)24/h1-7H,8-11H2,(H,18,24)