[2,5-dimethyl-4-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-1H-pyrrol-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2,5-dimethyl-4-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-1H-pyrrol-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [2,5-dimethyl-4-[4-(2-pyridyl)piperazin-1-yl]sulfonyl-1H-pyrrol-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [2,5-dimethyl-4-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-1H-pyrrol-3-yl]-(1-pyrrolidinyl)methanone IUPAC Name: [2,5-dimethyl-4-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-1H-pyrrol-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [2,5-dimethyl-4-[4-(2-pyridyl)piperazino]sulfonyl-1H-pyrrol-3-yl]-pyrrolidino-methanone Formula: C20H27N5O3S MolecularWeight: 417.52508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)S(=O)(=O)N2CCN(CC2)C3=CC=CC=N3)C(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=C(N1)C)S(=O)(=O)N2CCN(CC2)C3=CC=CC=N3)C(=O)N4CCCC4

InChI

InChI=1S/C20H27N5O3S/c1-15-18(20(26)24-9-5-6-10-24)19(16(2)22-15)29(27,28)25-13-11-23(12-14-25)17-7-3-4-8-21-17/h3-4,7-8,22H,5-6,9-14H2,1-2H3