2-[[6-(3-azanyl-3-methyl-piperidin-1-yl)-3-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[[6-(3-azanyl-3-methyl-piperidin-1-yl)-3-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 2-[[6-(3-amino-3-methyl-1-piperidyl)-3-methyl-2,4-dioxo-pyrimidin-1-yl]methyl]-4-fluoro-benzonitrile CAS Name: 2-[[6-(3-amino-3-methyl-1-piperidinyl)-3-methyl-2,4-dioxo-1-pyrimidinyl]methyl]-4-fluorobenzonitrile IUPAC Name: 2-[[6-(3-amino-3-methylpiperidin-1-yl)-3-methyl-2,4-dioxopyrimidin-1-yl]methyl]-4-fluorobenzonitrile Traditional Name: 2-[[6-(3-amino-3-methyl-piperidino)-2,4-diketo-3-methyl-pyrimidin-1-yl]methyl]-4-fluoro-benzonitrile Formula: C19H22FN5O2 MolecularWeight: 371.408683

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCN(C1)C2=CC(=O)N(C(=O)N2CC3=C(C=CC(=C3)F)C#N)C)N

Isomeric SMILES

CC1(CCCN(C1)C2=CC(=O)N(C(=O)N2CC3=C(C=CC(=C3)F)C#N)C)N

InChI

InChI=1S/C19H22FN5O2/c1-19(22)6-3-7-24(12-19)16-9-17(26)23(2)18(27)25(16)11-14-8-15(20)5-4-13(14)10-21/h4-5,8-9H,3,6-7,11-12,22H2,1-2H3