(5S)-1-(4-methylphenyl)sulfonyl-5-(4-methylpiperazin-4-ium-1-yl)carbonyl-pyrrolidin-2-one

Systemtic Name: (5S)-1-(4-methylphenyl)sulfonyl-5-(4-methylpiperazin-4-ium-1-yl)carbonyl-pyrrolidin-2-one Openeye Name: (5S)-5-(4-methylpiperazin-4-ium-1-carbonyl)-1-(p-tolylsulfonyl)pyrrolidin-2-one CAS Name: (5S)-1-(4-methylphenyl)sulfonyl-5-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-2-pyrrolidinone IUPAC Name: (5S)-1-(4-methylphenyl)sulfonyl-5-(4-methylpiperazin-4-ium-1-carbonyl)pyrrolidin-2-one Traditional Name: (5S)-5-(4-methylpiperazin-4-ium-1-carbonyl)-1-tosyl-2-pyrrolidone Formula: C17H24N3O4S+ MolecularWeight: 366.45516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2=O)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](CCC2=O)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C17H23N3O4S/c1-13-3-5-14(6-4-13)25(23,24)20-15(7-8-16(20)21)17(22)19-11-9-18(2)10-12-19/h3-6,15H,7-12H2,1-2H3/p+1/t15-/m0/s1