3-fluoranyl-4-methyl-5-[(1-methyl-3-propan-2-yl-pyrazol-4-yl)methylamino]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-methyl-5-[(1-methyl-3-propan-2-yl-pyrazol-4-yl)methylamino]benzenecarbonitrile Openeye Name: 3-fluoro-5-[(3-isopropyl-1-methyl-pyrazol-4-yl)methylamino]-4-methyl-benzonitrile CAS Name: 3-fluoro-4-methyl-5-[(1-methyl-3-propan-2-yl-4-pyrazolyl)methylamino]benzonitrile IUPAC Name: 3-fluoro-4-methyl-5-[(1-methyl-3-propan-2-ylpyrazol-4-yl)methylamino]benzonitrile Traditional Name: 3-fluoro-5-[(3-isopropyl-1-methyl-pyrazol-4-yl)methylamino]-4-methyl-benzonitrile Formula: C16H19FN4 MolecularWeight: 286.347263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C#N)NCC2=CN(N=C2C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1F)C#N)NCC2=CN(N=C2C(C)C)C

InChI

InChI=1S/C16H19FN4/c1-10(2)16-13(9-21(4)20-16)8-19-15-6-12(7-18)5-14(17)11(15)3/h5-6,9-10,19H,8H2,1-4H3