6-azanyl-3-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-5-piperidin-1-yl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-5-piperidin-1-yl-pyrimidine-2,4-dione Openeye Name: 6-amino-3-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-5-(1-piperidyl)pyrimidine-2,4-dione CAS Name: 6-amino-3-[[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]methyl]-1-methyl-5-(1-piperidinyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-3-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-1-methyl-5-piperidin-1-ylpyrimidine-2,4-dione Traditional Name: 6-amino-3-[[4-(4-fluorophenyl)sulfonylpiperazino]methyl]-1-methyl-5-piperidino-pyrimidine-2,4-quinone Formula: C21H29FN6O4S MolecularWeight: 480.556163

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)N4CCCCC4)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)N4CCCCC4)N

InChI

InChI=1S/C21H29FN6O4S/c1-24-19(23)18(26-9-3-2-4-10-26)20(29)28(21(24)30)15-25-11-13-27(14-12-25)33(31,32)17-7-5-16(22)6-8-17/h5-8H,2-4,9-15,23H2,1H3