4-nitro-3-(1-propan-2-ylpyrazol-4-yl)-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 4-nitro-3-(1-propan-2-ylpyrazol-4-yl)-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 3-(1-isopropylpyrazol-4-yl)-4-nitro-N-(4-pyridylmethyl)benzamide CAS Name: 4-nitro-3-(1-propan-2-yl-4-pyrazolyl)-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 4-nitro-3-(1-propan-2-ylpyrazol-4-yl)-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 3-(1-isopropylpyrazol-4-yl)-4-nitro-N-(4-pyridylmethyl)benzamide Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=N1)C2=C(C=CC(=C2)C(=O)NCC3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C=C(C=N1)C2=C(C=CC(=C2)C(=O)NCC3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O3/c1-13(2)23-12-16(11-22-23)17-9-15(3-4-18(17)24(26)27)19(25)21-10-14-5-7-20-8-6-14/h3-9,11-13H,10H2,1-2H3,(H,21,25)