1-[[4-[2-(6-methoxypyridin-3-yl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methyl]urea

Systemtic Name: 1-[[4-[2-(6-methoxypyridin-3-yl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methyl]urea Openeye Name: [4-[2-(6-methoxy-3-pyridyl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methylurea CAS Name: [4-[2-(6-methoxy-3-pyridinyl)-5-(2-methyl-1-oxopropyl)-3-pyrazolyl]phenyl]methylurea IUPAC Name: [4-[2-(6-methoxypyridin-3-yl)-5-(2-methylpropanoyl)pyrazol-3-yl]phenyl]methylurea Traditional Name: [4-[5-isobutyryl-2-(6-methoxy-3-pyridyl)pyrazol-3-yl]benzyl]urea Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=NN(C(=C1)C2=CC=C(C=C2)CNC(=O)N)C3=CN=C(C=C3)OC

Isomeric SMILES

CC(C)C(=O)C1=NN(C(=C1)C2=CC=C(C=C2)CNC(=O)N)C3=CN=C(C=C3)OC

InChI

InChI=1S/C21H23N5O3/c1-13(2)20(27)17-10-18(15-6-4-14(5-7-15)11-24-21(22)28)26(25-17)16-8-9-19(29-3)23-12-16/h4-10,12-13H,11H2,1-3H3,(H3,22,24,28)