2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(2-naphthylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1-[4-(2-naphthylsulfonyl)piperazino]ethanone Formula: C24H27N5O3S2 MolecularWeight: 497.63288

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC(=O)N4CCN(CC4)S(=O)(=O)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC(=O)N4CCN(CC4)S(=O)(=O)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C24H27N5O3S2/c30-22(16-33-24-26-25-23(18-5-6-18)29(24)20-8-9-20)27-11-13-28(14-12-27)34(31,32)21-10-7-17-3-1-2-4-19(17)15-21/h1-4,7,10,15,18,20H,5-6,8-9,11-14,16H2