1-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-2-(4-nitrophenyl)diazane

Systemtic Name: 1-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-2-(4-nitrophenyl)diazane Openeye Name: 1-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]-2-(4-nitrophenyl)hydrazine CAS Name: 1-[6-[(4-chlorophenyl)thio]-5-nitro-4-pyrimidinyl]-2-(4-nitrophenyl)hydrazine IUPAC Name: 1-[6-(4-chlorophenyl)sulfanyl-5-nitropyrimidin-4-yl]-2-(4-nitrophenyl)hydrazine Traditional Name: 1-[6-[(4-chlorophenyl)thio]-5-nitro-pyrimidin-4-yl]-2-(4-nitrophenyl)hydrazine Formula: C16H11ClN6O4S MolecularWeight: 418.81434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NNC2=C(C(=NC=N2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NNC2=C(C(=NC=N2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H11ClN6O4S/c17-10-1-7-13(8-2-10)28-16-14(23(26)27)15(18-9-19-16)21-20-11-3-5-12(6-4-11)22(24)25/h1-9,20H,(H,18,19,21)