N-(3,4-dimethylphenyl)-2,6-dimorpholin-4-yl-pyrimidine-4-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-2,6-dimorpholin-4-yl-pyrimidine-4-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-2,6-dimorpholino-pyrimidine-4-carboxamide CAS Name: N-(3,4-dimethylphenyl)-2,6-bis(4-morpholinyl)-4-pyrimidinecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-2,6-dimorpholin-4-ylpyrimidine-4-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-2,6-dimorpholino-pyrimidine-4-carboxamide Formula: C21H27N5O3 MolecularWeight: 397.47078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC(=N2)N3CCOCC3)N4CCOCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC(=N2)N3CCOCC3)N4CCOCC4)C

InChI

InChI=1S/C21H27N5O3/c1-15-3-4-17(13-16(15)2)22-20(27)18-14-19(25-5-9-28-10-6-25)24-21(23-18)26-7-11-29-12-8-26/h3-4,13-14H,5-12H2,1-2H3,(H,22,27)