2-(3-methoxy-4-nitro-phenyl)sulfanyl-6-methyl-pyrimidin-4-amine

Systemtic Name: 2-(3-methoxy-4-nitro-phenyl)sulfanyl-6-methyl-pyrimidin-4-amine Openeye Name: 2-(3-methoxy-4-nitro-phenyl)sulfanyl-6-methyl-pyrimidin-4-amine CAS Name: 2-[(3-methoxy-4-nitrophenyl)thio]-6-methyl-4-pyrimidinamine IUPAC Name: 2-(3-methoxy-4-nitrophenyl)sulfanyl-6-methylpyrimidin-4-amine Traditional Name: [2-[(3-methoxy-4-nitro-phenyl)thio]-6-methyl-pyrimidin-4-yl]amine Formula: C12H12N4O3S MolecularWeight: 292.31368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC(=C(C=C2)[N+](=O)[O-])OC)N

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC(=C(C=C2)[N+](=O)[O-])OC)N

InChI

InChI=1S/C12H12N4O3S/c1-7-5-11(13)15-12(14-7)20-8-3-4-9(16(17)18)10(6-8)19-2/h3-6H,1-2H3,(H2,13,14,15)