1-(4-methylpiperazin-1-yl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-ethanone

Systemtic Name: 1-(4-methylpiperazin-1-yl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-ethanone Openeye Name: 1-(4-methylpiperazin-1-yl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-ethanone CAS Name: 1-(4-methyl-1-piperazinyl)-2-[[4-(1-pyrrolidinylsulfonyl)phenyl]thio]ethanone IUPAC Name: 1-(4-methylpiperazin-1-yl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanylethanone Traditional Name: 1-(4-methylpiperazino)-2-[(4-pyrrolidinosulfonylphenyl)thio]ethanone Formula: C17H25N3O3S2 MolecularWeight: 383.5287

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CSC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CN1CCN(CC1)C(=O)CSC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H25N3O3S2/c1-18-10-12-19(13-11-18)17(21)14-24-15-4-6-16(7-5-15)25(22,23)20-8-2-3-9-20/h4-7H,2-3,8-14H2,1H3