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

Systemtic Name: N'-[6-[(3-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-(3-chloroanilino)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: N'-[6-(3-chloroanilino)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[6-(3-chloroanilino)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: N'-[6-(3-chloroanilino)-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C17H13ClN6O3 MolecularWeight: 384.77652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN6O3/c18-12-7-4-8-13(9-12)21-15-14(24(26)27)16(20-10-19-15)22-23-17(25)11-5-2-1-3-6-11/h1-10H,(H,23,25)(H2,19,20,21,22)