(4-phenyl-1-thiophen-2-ylsulfonyl-piperidin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (4-phenyl-1-thiophen-2-ylsulfonyl-piperidin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [4-phenyl-1-(2-thienylsulfonyl)-4-piperidyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (4-phenyl-1-thiophen-2-ylsulfonyl-4-piperidinyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-phenyl-1-thiophen-2-ylsulfonylpiperidin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [4-phenyl-1-(2-thienylsulfonyl)-4-piperidyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C24H27N5O3S2 MolecularWeight: 497.63288

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C24H27N5O3S2/c30-22(27-15-17-28(18-16-27)23-25-11-5-12-26-23)24(20-6-2-1-3-7-20)9-13-29(14-10-24)34(31,32)21-8-4-19-33-21/h1-8,11-12,19H,9-10,13-18H2