N-(3,5-dimethylphenyl)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(3,5-dimethylphenyl)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-amine Openeye Name: N-(3,5-dimethylphenyl)-5-nitro-6-(p-tolylsulfanyl)pyrimidin-4-amine CAS Name: N-(3,5-dimethylphenyl)-6-[(4-methylphenyl)thio]-5-nitro-4-pyrimidinamine IUPAC Name: N-(3,5-dimethylphenyl)-6-(4-methylphenyl)sulfanyl-5-nitropyrimidin-4-amine Traditional Name: (3,5-dimethylphenyl)-[5-nitro-6-(p-tolylthio)pyrimidin-4-yl]amine Formula: C19H18N4O2S MolecularWeight: 366.43682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C19H18N4O2S/c1-12-4-6-16(7-5-12)26-19-17(23(24)25)18(20-11-21-19)22-15-9-13(2)8-14(3)10-15/h4-11H,1-3H3,(H,20,21,22)