4-(4-fluorophenyl)-6-methyl-2-(5-piperidin-1-ylpentylsulfanyl)pyrimidine hydrochloride

Systemtic Name: 4-(4-fluorophenyl)-6-methyl-2-(5-piperidin-1-ylpentylsulfanyl)pyrimidine hydrochloride Openeye Name: 4-(4-fluorophenyl)-6-methyl-2-[5-(1-piperidyl)pentylsulfanyl]pyrimidine hydrochloride CAS Name: 4-(4-fluorophenyl)-6-methyl-2-[5-(1-piperidinyl)pentylthio]pyrimidine hydrochloride IUPAC Name: 4-(4-fluorophenyl)-6-methyl-2-(5-piperidin-1-ylpentylsulfanyl)pyrimidine hydrochloride Traditional Name: 4-(4-fluorophenyl)-6-methyl-2-(5-piperidinopentylthio)pyrimidine hydrochloride Formula: C21H29ClFN3S MolecularWeight: 409.991463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=C(C=C2)F)SCCCCCN3CCCCC3.Cl

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=C(C=C2)F)SCCCCCN3CCCCC3.Cl

InChI

InChI=1S/C21H28FN3S.ClH/c1-17-16-20(18-8-10-19(22)11-9-18)24-21(23-17)26-15-7-3-6-14-25-12-4-2-5-13-25;/h8-11,16H,2-7,12-15H2,1H3;1H