[(2R)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [(2R)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [(2R)-1-(p-tolylsulfonyl)pyrrolidin-2-yl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [(2R)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [(2R)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [4-(2-pyridyl)piperazino]-[(2R)-1-tosylpyrrolidin-2-yl]methanone Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H]2C(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C21H26N4O3S/c1-17-7-9-18(10-8-17)29(27,28)25-12-4-5-19(25)21(26)24-15-13-23(14-16-24)20-6-2-3-11-22-20/h2-3,6-11,19H,4-5,12-16H2,1H3/t19-/m1/s1