4-(4-methyl-2-morpholin-4-yl-1,3-thiazol-5-yl)-N-(3-nitrophenyl)pyrimidin-2-amine

Systemtic Name: 4-(4-methyl-2-morpholin-4-yl-1,3-thiazol-5-yl)-N-(3-nitrophenyl)pyrimidin-2-amine Openeye Name: 4-(4-methyl-2-morpholino-thiazol-5-yl)-N-(3-nitrophenyl)pyrimidin-2-amine CAS Name: 4-[4-methyl-2-(4-morpholinyl)-5-thiazolyl]-N-(3-nitrophenyl)-2-pyrimidinamine IUPAC Name: 4-(4-methyl-2-morpholin-4-yl-1,3-thiazol-5-yl)-N-(3-nitrophenyl)pyrimidin-2-amine Traditional Name: [4-(4-methyl-2-morpholino-thiazol-5-yl)pyrimidin-2-yl]-(3-nitrophenyl)amine Formula: C18H18N6O3S MolecularWeight: 398.43892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2CCOCC2)C3=NC(=NC=C3)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)N2CCOCC2)C3=NC(=NC=C3)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O3S/c1-12-16(28-18(20-12)23-7-9-27-10-8-23)15-5-6-19-17(22-15)21-13-3-2-4-14(11-13)24(25)26/h2-6,11H,7-10H2,1H3,(H,19,21,22)