2-phenyl-6-[4-(phenylmethyl)-1-thiophen-2-ylsulfonyl-piperazin-2-yl]-1H-pyrimidin-4-one

Systemtic Name: 2-phenyl-6-[4-(phenylmethyl)-1-thiophen-2-ylsulfonyl-piperazin-2-yl]-1H-pyrimidin-4-one Openeye Name: 6-[4-benzyl-1-(2-thienylsulfonyl)piperazin-2-yl]-2-phenyl-1H-pyrimidin-4-one CAS Name: 2-phenyl-6-[4-(phenylmethyl)-1-thiophen-2-ylsulfonyl-2-piperazinyl]-1H-pyrimidin-4-one IUPAC Name: 6-(4-benzyl-1-thiophen-2-ylsulfonylpiperazin-2-yl)-2-phenyl-1H-pyrimidin-4-one Traditional Name: 6-[4-benzyl-1-(2-thienylsulfonyl)piperazin-2-yl]-2-phenyl-1H-pyrimidin-4-one Formula: C25H24N4O3S2 MolecularWeight: 492.61306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2=CC=CC=C2)C3=CC(=O)N=C(N3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(C(CN1CC2=CC=CC=C2)C3=CC(=O)N=C(N3)C4=CC=CC=C4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C25H24N4O3S2/c30-23-16-21(26-25(27-23)20-10-5-2-6-11-20)22-18-28(17-19-8-3-1-4-9-19)13-14-29(22)34(31,32)24-12-7-15-33-24/h1-12,15-16,22H,13-14,17-18H2,(H,26,27,30)