N'-[5-nitro-6-[(4-propan-2-ylphenyl)amino]pyrimidin-4-yl]furan-2-carbohydrazide

Systemtic Name: N'-[5-nitro-6-[(4-propan-2-ylphenyl)amino]pyrimidin-4-yl]furan-2-carbohydrazide Openeye Name: N'-[6-(4-isopropylanilino)-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide CAS Name: N'-[5-nitro-6-(4-propan-2-ylanilino)-4-pyrimidinyl]-2-furancarbohydrazide IUPAC Name: N'-[5-nitro-6-(4-propan-2-ylanilino)pyrimidin-4-yl]furan-2-carbohydrazide Traditional Name: N'-(6-cumidino-5-nitro-pyrimidin-4-yl)-2-furohydrazide Formula: C18H18N6O4 MolecularWeight: 382.37332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N6O4/c1-11(2)12-5-7-13(8-6-12)21-16-15(24(26)27)17(20-10-19-16)22-23-18(25)14-4-3-9-28-14/h3-11H,1-2H3,(H,23,25)(H2,19,20,21,22)