N3-[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]benzene-1,3-diamine

Systemtic Name: N3-[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]benzene-1,3-diamine Openeye Name: N3-[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]benzene-1,3-diamine CAS Name: N3-[4-(3-methyl-1-phenyl-4-pyrazolyl)-2-pyrimidinyl]benzene-1,3-diamine IUPAC Name: 3-N-[4-(3-methyl-1-phenylpyrazol-4-yl)pyrimidin-2-yl]benzene-1,3-diamine Traditional Name: (3-aminophenyl)-[4-(3-methyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amine Formula: C20H18N6 MolecularWeight: 342.39712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N6/c1-14-18(13-26(25-14)17-8-3-2-4-9-17)19-10-11-22-20(24-19)23-16-7-5-6-15(21)12-16/h2-13H,21H2,1H3,(H,22,23,24)