5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-(1-oxidanylidene-1-pyrrolidin-1-yl-hexan-2-yl)sulfanyl-pyrimidin-4-one

Systemtic Name: 5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-(1-oxidanylidene-1-pyrrolidin-1-yl-hexan-2-yl)sulfanyl-pyrimidin-4-one Openeye Name: 5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-[1-(pyrrolidine-1-carbonyl)pentylsulfanyl]pyrimidin-4-one CAS Name: 5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-[[1-oxo-1-(1-pyrrolidinyl)hexan-2-yl]thio]-4-pyrimidinone IUPAC Name: 5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-(1-oxo-1-pyrrolidin-1-ylhexan-2-yl)sulfanylpyrimidin-4-one Traditional Name: 5-(4-fluorobenzyl)-3,6-dimethyl-2-[1-(pyrrolidine-1-carbonyl)pentylthio]pyrimidin-4-one Formula: C23H30FN3O2S MolecularWeight: 431.566603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)N1CCCC1)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CCCCC(C(=O)N1CCCC1)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C23H30FN3O2S/c1-4-5-8-20(22(29)27-13-6-7-14-27)30-23-25-16(2)19(21(28)26(23)3)15-17-9-11-18(24)12-10-17/h9-12,20H,4-8,13-15H2,1-3H3