4-[[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amino]benzamide

Systemtic Name: 4-[[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amino]benzamide Openeye Name: 4-[[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amino]benzamide CAS Name: 4-[[4-(3-methyl-1-phenyl-4-pyrazolyl)-2-pyrimidinyl]amino]benzamide IUPAC Name: 4-[[4-(3-methyl-1-phenylpyrazol-4-yl)pyrimidin-2-yl]amino]benzamide Traditional Name: 4-[[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amino]benzamide Formula: C21H18N6O MolecularWeight: 370.40722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NC(=NC=C2)NC3=CC=C(C=C3)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C=C1C2=NC(=NC=C2)NC3=CC=C(C=C3)C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C21H18N6O/c1-14-18(13-27(26-14)17-5-3-2-4-6-17)19-11-12-23-21(25-19)24-16-9-7-15(8-10-16)20(22)28/h2-13H,1H3,(H2,22,28)(H,23,24,25)