[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(1-thiophen-2-ylcarbonylpyrrolidin-2-yl)methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(1-thiophen-2-ylcarbonylpyrrolidin-2-yl)methanone Openeye Name: [4-(p-tolylsulfonyl)piperazin-1-yl]-[1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-[1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone Traditional Name: [1-(2-thenoyl)pyrrolidin-2-yl]-(4-tosylpiperazino)methanone Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4S2/c1-16-6-8-17(9-7-16)30(27,28)23-13-11-22(12-14-23)20(25)18-4-2-10-24(18)21(26)19-5-3-15-29-19/h3,5-9,15,18H,2,4,10-14H2,1H3