(4-pyrimidin-2-ylpiperazin-1-yl)-[(3R)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone

Systemtic Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[(3R)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone Openeye Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[(3R)-1-(2-thienylsulfonyl)-3-piperidyl]methanone CAS Name: [4-(2-pyrimidinyl)-1-piperazinyl]-[(3R)-1-thiophen-2-ylsulfonyl-3-piperidinyl]methanone IUPAC Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[(3R)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone Traditional Name: [4-(2-pyrimidyl)piperazino]-[(3R)-1-(2-thienylsulfonyl)-3-piperidyl]methanone Formula: C18H23N5O3S2 MolecularWeight: 421.53692

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1C[C@H](CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C18H23N5O3S2/c24-17(21-9-11-22(12-10-21)18-19-6-3-7-20-18)15-4-1-8-23(14-15)28(25,26)16-5-2-13-27-16/h2-3,5-7,13,15H,1,4,8-12,14H2/t15-/m1/s1