N6-(4,5-dimethyl-1,3-thiazol-2-yl)-N4-(1-methoxypropan-2-yl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(4,5-dimethyl-1,3-thiazol-2-yl)-N4-(1-methoxypropan-2-yl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(4,5-dimethylthiazol-2-yl)-N4-(2-methoxy-1-methyl-ethyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(4,5-dimethyl-2-thiazolyl)-N4-(1-methoxypropan-2-yl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(4,5-dimethyl-1,3-thiazol-2-yl)-4-N-(1-methoxypropan-2-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: (4,5-dimethylthiazol-2-yl)-[6-[(2-methoxy-1-methyl-ethyl)amino]-5-nitro-pyrimidin-4-yl]amine Formula: C13H18N6O3S MolecularWeight: 338.38542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=C(C(=NC=N2)NC(C)COC)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=N1)NC2=C(C(=NC=N2)NC(C)COC)[N+](=O)[O-])C

InChI

InChI=1S/C13H18N6O3S/c1-7(5-22-4)16-11-10(19(20)21)12(15-6-14-11)18-13-17-8(2)9(3)23-13/h6-7H,5H2,1-4H3,(H2,14,15,16,17,18)