N-(4-ethoxyphenyl)-4-(6-piperazin-1-ylpyridin-3-yl)pyrimidin-2-amine; N-methylmethanamine

Systemtic Name: N-(4-ethoxyphenyl)-4-(6-piperazin-1-ylpyridin-3-yl)pyrimidin-2-amine; N-methylmethanamine Openeye Name: N-(4-ethoxyphenyl)-4-(6-piperazin-1-yl-3-pyridyl)pyrimidin-2-amine; N-methylmethanamine CAS Name: N-(4-ethoxyphenyl)-4-[6-(1-piperazinyl)-3-pyridinyl]-2-pyrimidinamine; N-methylmethanamine IUPAC Name: N-(4-ethoxyphenyl)-4-(6-piperazin-1-ylpyridin-3-yl)pyrimidin-2-amine; N-methylmethanamine Traditional Name: dimethylamine; [4-(6-piperazino-3-pyridyl)pyrimidin-2-yl]-p-phenetyl-amine Formula: C23H31N7O MolecularWeight: 421.53854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CN=C(C=C3)N4CCNCC4.CNC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CN=C(C=C3)N4CCNCC4.CNC

InChI

InChI=1S/C21H24N6O.C2H7N/c1-2-28-18-6-4-17(5-7-18)25-21-23-10-9-19(26-21)16-3-8-20(24-15-16)27-13-11-22-12-14-27;1-3-2/h3-10,15,22H,2,11-14H2,1H3,(H,23,25,26);3H,1-2H3