[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-(1-pyrimidin-2-ylpiperidin-4-yl)methanone

Systemtic Name: [4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-(1-pyrimidin-2-ylpiperidin-4-yl)methanone Openeye Name: [4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-(1-pyrimidin-2-yl-4-piperidyl)methanone CAS Name: [4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-[1-(2-pyrimidinyl)-4-piperidinyl]methanone IUPAC Name: [4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-(1-pyrimidin-2-ylpiperidin-4-yl)methanone Traditional Name: (4-nosylpiperazino)-[1-(2-pyrimidyl)-4-piperidyl]methanone Formula: C20H24N6O5S MolecularWeight: 460.50676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=NC=CC=N4

InChI

InChI=1S/C20H24N6O5S/c27-19(16-6-10-24(11-7-16)20-21-8-1-9-22-20)23-12-14-25(15-13-23)32(30,31)18-4-2-17(3-5-18)26(28)29/h1-5,8-9,16H,6-7,10-15H2