N-(3-methylpyridin-2-yl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-(3-methylpyridin-2-yl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine Openeye Name: N-(3-methyl-2-pyridyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine CAS Name: N-(3-methyl-2-pyridinyl)-5-nitro-6-(phenylthio)-4-pyrimidinamine IUPAC Name: N-(3-methylpyridin-2-yl)-5-nitro-6-phenylsulfanylpyrimidin-4-amine Traditional Name: (3-methyl-2-pyridyl)-[5-nitro-6-(phenylthio)pyrimidin-4-yl]amine Formula: C16H13N5O2S MolecularWeight: 339.37172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NC2=C(C(=NC=N2)SC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=CC=C1)NC2=C(C(=NC=N2)SC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O2S/c1-11-6-5-9-17-14(11)20-15-13(21(22)23)16(19-10-18-15)24-12-7-3-2-4-8-12/h2-10H,1H3,(H,17,18,19,20)