1-[6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-2-phenyl-diazane

Systemtic Name: 1-[6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-2-phenyl-diazane Openeye Name: 1-[5-nitro-6-(p-tolylsulfanyl)pyrimidin-4-yl]-2-phenyl-hydrazine CAS Name: 1-[6-[(4-methylphenyl)thio]-5-nitro-4-pyrimidinyl]-2-phenylhydrazine IUPAC Name: 1-[6-(4-methylphenyl)sulfanyl-5-nitropyrimidin-4-yl]-2-phenylhydrazine Traditional Name: 1-[5-nitro-6-(p-tolylthio)pyrimidin-4-yl]-2-phenyl-hydrazine Formula: C17H15N5O2S MolecularWeight: 353.3983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NNC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NNC3=CC=CC=C3

InChI

InChI=1S/C17H15N5O2S/c1-12-7-9-14(10-8-12)25-17-15(22(23)24)16(18-11-19-17)21-20-13-5-3-2-4-6-13/h2-11,20H,1H3,(H,18,19,21)