4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]butanamide

Systemtic Name: 4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]butanamide Openeye Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: 4-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)-N-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]butanamide IUPAC Name: N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-4-(4-chloro-5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C20H23ClN6O3 MolecularWeight: 430.88802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=O)CCCN3C(=C(C(=N3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=O)CCCN3C(=C(C(=N3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C20H23ClN6O3/c1-13-19(15(3)26(23-13)12-16-8-5-4-6-9-16)22-17(28)10-7-11-25-14(2)18(21)20(24-25)27(29)30/h4-6,8-9H,7,10-12H2,1-3H3,(H,22,28)