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

Systemtic Name: 3-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]pyrazol-4-yl]propanamide Openeye Name: 3-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(m-tolylmethyl)pyrazol-4-yl]propanamide CAS Name: 3-(5-methyl-3-nitro-1-pyrazolyl)-N-[1-[(3-methylphenyl)methyl]-4-pyrazolyl]propanamide IUPAC Name: 3-(5-methyl-3-nitropyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]pyrazol-4-yl]propanamide Traditional Name: N-[1-(3-methylbenzyl)pyrazol-4-yl]-3-(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=C1)CN2C=C(C=N2)NC(=O)CCN3C(=CC(=N3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=C(C=N2)NC(=O)CCN3C(=CC(=N3)[N+](=O)[O-])C

InChI

InChI=1S/C18H20N6O3/c1-13-4-3-5-15(8-13)11-22-12-16(10-19-22)20-18(25)6-7-23-14(2)9-17(21-23)24(26)27/h3-5,8-10,12H,6-7,11H2,1-2H3,(H,20,25)