4-(4-methoxyphenyl)-2-[3-(methylamino)propyl]-6-morpholin-4-yl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-methoxyphenyl)-2-[3-(methylamino)propyl]-6-morpholin-4-yl-pyrimidine-5-carbonitrile Openeye Name: 4-(4-methoxyphenyl)-2-[3-(methylamino)propyl]-6-morpholino-pyrimidine-5-carbonitrile CAS Name: 4-(4-methoxyphenyl)-2-[3-(methylamino)propyl]-6-(4-morpholinyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-methoxyphenyl)-2-[3-(methylamino)propyl]-6-morpholin-4-ylpyrimidine-5-carbonitrile Traditional Name: 4-(4-methoxyphenyl)-2-[3-(methylamino)propyl]-6-morpholino-pyrimidine-5-carbonitrile Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCC1=NC(=C(C(=N1)N2CCOCC2)C#N)C3=CC=C(C=C3)OC

Isomeric SMILES

CNCCCC1=NC(=C(C(=N1)N2CCOCC2)C#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H25N5O2/c1-22-9-3-4-18-23-19(15-5-7-16(26-2)8-6-15)17(14-21)20(24-18)25-10-12-27-13-11-25/h5-8,22H,3-4,9-13H2,1-2H3