1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(4-brosylpiperazino)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C17H20BrN5O3S2 MolecularWeight: 486.4064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=NN=C2SCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CC1N2C=NN=C2SCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C17H20BrN5O3S2/c18-13-1-5-15(6-2-13)28(25,26)22-9-7-21(8-10-22)16(24)11-27-17-20-19-12-23(17)14-3-4-14/h1-2,5-6,12,14H,3-4,7-11H2