N,6-dimethyl-2-methylsulfanyl-5-nitro-N-(phenylmethyl)pyrimidin-4-amine

Systemtic Name: N,6-dimethyl-2-methylsulfanyl-5-nitro-N-(phenylmethyl)pyrimidin-4-amine Openeye Name: N-benzyl-N,6-dimethyl-2-methylsulfanyl-5-nitro-pyrimidin-4-amine CAS Name: N,6-dimethyl-2-(methylthio)-5-nitro-N-(phenylmethyl)-4-pyrimidinamine IUPAC Name: N-benzyl-N,6-dimethyl-2-methylsulfanyl-5-nitropyrimidin-4-amine Traditional Name: benzyl-methyl-[6-methyl-2-(methylthio)-5-nitro-pyrimidin-4-yl]amine Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)N(C)CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)N(C)CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O2S/c1-10-12(18(19)20)13(16-14(15-10)21-3)17(2)9-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3