N-methyl-6-(4-methylphenyl)sulfanyl-5-nitro-N-(phenylmethyl)pyrimidin-4-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])N(C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])N(C)CC3=CC=CC=C3

InChI

InChI=1S/C19H18N4O2S/c1-14-8-10-16(11-9-14)26-19-17(23(24)25)18(20-13-21-19)22(2)12-15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3