2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]butanamide

Systemtic Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]butanamide Openeye Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]butanamide CAS Name: 2-(5-methyl-3-nitro-1-pyrazolyl)-N-[3-(1-pyrazolylmethyl)phenyl]butanamide IUPAC Name: 2-(5-methyl-3-nitropyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]butanamide Traditional Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]butyramide Formula: C18H20N6O3 MolecularWeight: 368.3898

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)CN2C=CC=N2)N3C(=CC(=N3)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)CN2C=CC=N2)N3C(=CC(=N3)[N+](=O)[O-])C

InChI

InChI=1S/C18H20N6O3/c1-3-16(23-13(2)10-17(21-23)24(26)27)18(25)20-15-7-4-6-14(11-15)12-22-9-5-8-19-22/h4-11,16H,3,12H2,1-2H3,(H,20,25)