N-(5-chloranyl-2-methyl-phenyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine Openeye Name: N-(5-chloro-2-methyl-phenyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine CAS Name: N-(5-chloro-2-methylphenyl)-5-nitro-6-(phenylthio)-4-pyrimidinamine IUPAC Name: N-(5-chloro-2-methylphenyl)-5-nitro-6-phenylsulfanylpyrimidin-4-amine Traditional Name: (5-chloro-2-methyl-phenyl)-[5-nitro-6-(phenylthio)pyrimidin-4-yl]amine Formula: C17H13ClN4O2S MolecularWeight: 372.82872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN4O2S/c1-11-7-8-12(18)9-14(11)21-16-15(22(23)24)17(20-10-19-16)25-13-5-3-2-4-6-13/h2-10H,1H3,(H,19,20,21)