N-[[4-(5-cyano-2,3-dimethyl-pyrrol-1-yl)phenyl]methyl]-N-(4-methyl-3-nitro-pyridin-2-yl)butanamide

Systemtic Name: N-[[4-(5-cyano-2,3-dimethyl-pyrrol-1-yl)phenyl]methyl]-N-(4-methyl-3-nitro-pyridin-2-yl)butanamide Openeye Name: N-[[4-(5-cyano-2,3-dimethyl-pyrrol-1-yl)phenyl]methyl]-N-(4-methyl-3-nitro-2-pyridyl)butanamide CAS Name: N-[[4-(5-cyano-2,3-dimethyl-1-pyrrolyl)phenyl]methyl]-N-(4-methyl-3-nitro-2-pyridinyl)butanamide IUPAC Name: N-[[4-(5-cyano-2,3-dimethylpyrrol-1-yl)phenyl]methyl]-N-(4-methyl-3-nitropyridin-2-yl)butanamide Traditional Name: N-[4-(5-cyano-2,3-dimethyl-pyrrol-1-yl)benzyl]-N-(4-methyl-3-nitro-2-pyridyl)butyramide Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(CC1=CC=C(C=C1)N2C(=C(C=C2C#N)C)C)C3=NC=CC(=C3[N+](=O)[O-])C

Isomeric SMILES

CCCC(=O)N(CC1=CC=C(C=C1)N2C(=C(C=C2C#N)C)C)C3=NC=CC(=C3[N+](=O)[O-])C

InChI

InChI=1S/C24H25N5O3/c1-5-6-22(30)27(24-23(29(31)32)16(2)11-12-26-24)15-19-7-9-20(10-8-19)28-18(4)17(3)13-21(28)14-25/h7-13H,5-6,15H2,1-4H3