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

Systemtic Name: 4-azanyl-N-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methyl]-N-methyl-3-nitro-benzamide Openeye Name: 4-amino-N-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methyl]-N-methyl-3-nitro-benzamide CAS Name: 4-amino-N-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]methyl]-N-methyl-3-nitrobenzamide IUPAC Name: 4-amino-N-[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]methyl]-N-methyl-3-nitrobenzamide Traditional Name: 4-amino-N-[[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]methyl]-N-methyl-3-nitro-benzamide Formula: C21H22ClN5O3 MolecularWeight: 427.88408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)CN(C)C(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)CN(C)C(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C21H22ClN5O3/c1-13-17(14(2)26(24-13)11-16-6-4-5-7-18(16)22)12-25(3)21(28)15-8-9-19(23)20(10-15)27(29)30/h4-10H,11-12,23H2,1-3H3