N'-[6-[(3-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]-2-phenyl-ethanehydrazide

Systemtic Name: N'-[6-[(3-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]-2-phenyl-ethanehydrazide Openeye Name: N'-[6-(3-chloroanilino)-5-nitro-pyrimidin-4-yl]-2-phenyl-acetohydrazide CAS Name: N'-[6-(3-chloroanilino)-5-nitro-4-pyrimidinyl]-2-phenylacetohydrazide IUPAC Name: N'-[6-(3-chloroanilino)-5-nitropyrimidin-4-yl]-2-phenylacetohydrazide Traditional Name: N'-[6-(3-chloroanilino)-5-nitro-pyrimidin-4-yl]-2-phenyl-acetohydrazide Formula: C18H15ClN6O3 MolecularWeight: 398.8031

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H15ClN6O3/c19-13-7-4-8-14(10-13)22-17-16(25(27)28)18(21-11-20-17)24-23-15(26)9-12-5-2-1-3-6-12/h1-8,10-11H,9H2,(H,23,26)(H2,20,21,22,24)