4-imidazol-1-yl-N-[(1S,2R)-2-methoxy-2,3-dihydro-1H-inden-1-yl]-6-methyl-5-nitro-pyrimidin-2-amine

Systemtic Name: 4-imidazol-1-yl-N-[(1S,2R)-2-methoxy-2,3-dihydro-1H-inden-1-yl]-6-methyl-5-nitro-pyrimidin-2-amine Openeye Name: 4-imidazol-1-yl-N-[(1S,2R)-2-methoxyindan-1-yl]-6-methyl-5-nitro-pyrimidin-2-amine CAS Name: 4-(1-imidazolyl)-N-[(1S,2R)-2-methoxy-2,3-dihydro-1H-inden-1-yl]-6-methyl-5-nitro-2-pyrimidinamine IUPAC Name: 4-imidazol-1-yl-N-[(1S,2R)-2-methoxy-2,3-dihydro-1H-inden-1-yl]-6-methyl-5-nitropyrimidin-2-amine Traditional Name: (4-imidazol-1-yl-6-methyl-5-nitro-pyrimidin-2-yl)-[(1S,2R)-2-methoxyindan-1-yl]amine Formula: C18H18N6O3 MolecularWeight: 366.37392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NC2C(CC3=CC=CC=C23)OC)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)N[C@@H]2[C@@H](CC3=CC=CC=C23)OC)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O3/c1-11-16(24(25)26)17(23-8-7-19-10-23)22-18(20-11)21-15-13-6-4-3-5-12(13)9-14(15)27-2/h3-8,10,14-15H,9H2,1-2H3,(H,20,21,22)/t14-,15+/m1/s1