tert-butyl N-[1-[[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[1-[[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-N-methyl-carbamate Openeye Name: tert-butyl N-[1-benzyl-2-[[5-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]amino]-2-oxo-ethyl]-N-methyl-carbamate CAS Name: N-[1-[[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]-N-methylcarbamate Traditional Name: N-[1-benzyl-2-[[5-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]amino]-2-keto-ethyl]-N-methyl-carbamic acid tert-butyl ester Formula: C29H30FN5O3 MolecularWeight: 515.578603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)C(CC1=CC=CC=C1)C(=O)NC2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)OC(=O)N(C)C(CC1=CC=CC=C1)C(=O)NC2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C29H30FN5O3/c1-29(2,3)38-28(37)35(4)23(18-19-8-6-5-7-9-19)27(36)32-26-24(20-14-16-31-17-15-20)25(33-34-26)21-10-12-22(30)13-11-21/h5-17,23H,18H2,1-4H3,(H2,32,33,34,36)