2-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]phenyl]carbonylamino]-N-methyl-benzamide

Systemtic Name: 2-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]phenyl]carbonylamino]-N-methyl-benzamide Openeye Name: 2-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzoyl]amino]-N-methyl-benzamide CAS Name: 2-[[[4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]phenyl]-oxomethyl]amino]-N-methylbenzamide IUPAC Name: 2-[[4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzoyl]amino]-N-methylbenzamide Traditional Name: 2-[[4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzoyl]amino]-N-methyl-benzamide Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NC)C)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O4/c1-13-19(26(29)30)14(2)25(24-13)12-15-8-10-16(11-9-15)20(27)23-18-7-5-4-6-17(18)21(28)22-3/h4-11H,12H2,1-3H3,(H,22,28)(H,23,27)