[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone

Systemtic Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methanone Openeye Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone CAS Name: [4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-[(2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]methanone IUPAC Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone Traditional Name: [4-(2,5-dimethylphenyl)sulfonylpiperazino]-[(2S)-1-(2-thenoyl)pyrrolidin-2-yl]methanone Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3CCCN3C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)[C@@H]3CCCN3C(=O)C4=CC=CS4

InChI

InChI=1S/C22H27N3O4S2/c1-16-7-8-17(2)20(15-16)31(28,29)24-12-10-23(11-13-24)21(26)18-5-3-9-25(18)22(27)19-6-4-14-30-19/h4,6-8,14-15,18H,3,5,9-13H2,1-2H3/t18-/m0/s1