N'-[5-nitro-6-(pyridin-3-ylmethylamino)pyrimidin-4-yl]naphthalene-1-carbohydrazide

Systemtic Name: N'-[5-nitro-6-(pyridin-3-ylmethylamino)pyrimidin-4-yl]naphthalene-1-carbohydrazide Openeye Name: N'-[5-nitro-6-(3-pyridylmethylamino)pyrimidin-4-yl]naphthalene-1-carbohydrazide CAS Name: N'-[5-nitro-6-(3-pyridinylmethylamino)-4-pyrimidinyl]-1-naphthalenecarbohydrazide IUPAC Name: N'-[5-nitro-6-(pyridin-3-ylmethylamino)pyrimidin-4-yl]naphthalene-1-carbohydrazide Traditional Name: N'-[5-nitro-6-(3-pyridylmethylamino)pyrimidin-4-yl]naphthalene-1-carbohydrazide Formula: C21H17N7O3 MolecularWeight: 415.40478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)NNC3=NC=NC(=C3[N+](=O)[O-])NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)NNC3=NC=NC(=C3[N+](=O)[O-])NCC4=CN=CC=C4

InChI

InChI=1S/C21H17N7O3/c29-21(17-9-3-7-15-6-1-2-8-16(15)17)27-26-20-18(28(30)31)19(24-13-25-20)23-12-14-5-4-10-22-11-14/h1-11,13H,12H2,(H,27,29)(H2,23,24,25,26)