N-(4-ethoxy-2-methyl-5-propan-2-yl-phenyl)-2-[4-(1,2,3-triazol-1-yl)piperidin-1-yl]pyrimidin-4-amine

Systemtic Name: N-(4-ethoxy-2-methyl-5-propan-2-yl-phenyl)-2-[4-(1,2,3-triazol-1-yl)piperidin-1-yl]pyrimidin-4-amine Openeye Name: N-(4-ethoxy-5-isopropyl-2-methyl-phenyl)-2-[4-(triazol-1-yl)-1-piperidyl]pyrimidin-4-amine CAS Name: N-(4-ethoxy-2-methyl-5-propan-2-ylphenyl)-2-[4-(1-triazolyl)-1-piperidinyl]-4-pyrimidinamine IUPAC Name: N-(4-ethoxy-2-methyl-5-propan-2-ylphenyl)-2-[4-(triazol-1-yl)piperidin-1-yl]pyrimidin-4-amine Traditional Name: (4-ethoxy-5-isopropyl-2-methyl-phenyl)-[2-[4-(triazol-1-yl)piperidino]pyrimidin-4-yl]amine Formula: C23H31N7O MolecularWeight: 421.53854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C(C)C)NC2=NC(=NC=C2)N3CCC(CC3)N4C=CN=N4)C

Isomeric SMILES

CCOC1=CC(=C(C=C1C(C)C)NC2=NC(=NC=C2)N3CCC(CC3)N4C=CN=N4)C

InChI

InChI=1S/C23H31N7O/c1-5-31-21-14-17(4)20(15-19(21)16(2)3)26-22-6-9-24-23(27-22)29-11-7-18(8-12-29)30-13-10-25-28-30/h6,9-10,13-16,18H,5,7-8,11-12H2,1-4H3,(H,24,26,27)