2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]propanamide

Systemtic Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]propanamide Openeye Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(o-tolylmethyl)pyrazol-4-yl]propanamide CAS Name: 2-(5-methyl-3-nitro-1-pyrazolyl)-N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]propanamide IUPAC Name: 2-(5-methyl-3-nitropyrazol-1-yl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]propanamide Traditional Name: N-[1-(2-methylbenzyl)pyrazol-4-yl]-2-(5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C18H20N6O3 MolecularWeight: 368.3898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C(C)N3C(=CC(=N3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C(C)N3C(=CC(=N3)[N+](=O)[O-])C

InChI

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