2-[(2-azanylcyclohexyl)amino]-4-[(3-methylphenyl)amino]-6-phenylmethoxy-pyrimidine-5-carboxamide

Systemtic Name: 2-[(2-azanylcyclohexyl)amino]-4-[(3-methylphenyl)amino]-6-phenylmethoxy-pyrimidine-5-carboxamide Openeye Name: 2-[(2-aminocyclohexyl)amino]-4-benzyloxy-6-(3-methylanilino)pyrimidine-5-carboxamide CAS Name: 2-[(2-aminocyclohexyl)amino]-4-(3-methylanilino)-6-phenylmethoxy-5-pyrimidinecarboxamide IUPAC Name: 2-[(2-aminocyclohexyl)amino]-4-(3-methylanilino)-6-phenylmethoxypyrimidine-5-carboxamide Traditional Name: 2-[(2-aminocyclohexyl)amino]-4-benzoxy-6-(m-toluidino)pyrimidine-5-carboxamide Formula: C25H30N6O2 MolecularWeight: 446.5447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C(C(=NC(=N2)NC3CCCCC3N)OCC4=CC=CC=C4)C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C(C(=NC(=N2)NC3CCCCC3N)OCC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C25H30N6O2/c1-16-8-7-11-18(14-16)28-23-21(22(27)32)24(33-15-17-9-3-2-4-10-17)31-25(30-23)29-20-13-6-5-12-19(20)26/h2-4,7-11,14,19-20H,5-6,12-13,15,26H2,1H3,(H2,27,32)(H2,28,29,30,31)