N-(2-dimethylaminoethyl)-2-(4-nitrophenyl)-5-phenyl-N-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-(4-nitrophenyl)-5-phenyl-N-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: N-benzyl-N-(2-dimethylaminoethyl)-2-(4-nitrophenyl)-5-phenyl-pyrazole-3-carboxamide CAS Name: N-(2-dimethylaminoethyl)-2-(4-nitrophenyl)-5-phenyl-N-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-benzyl-N-(2-dimethylaminoethyl)-2-(4-nitrophenyl)-5-phenylpyrazole-3-carboxamide Traditional Name: N-benzyl-N-(2-dimethylaminoethyl)-2-(4-nitrophenyl)-5-phenyl-pyrazole-3-carboxamide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(CC1=CC=CC=C1)C(=O)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CN(C)CCN(CC1=CC=CC=C1)C(=O)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C27H27N5O3/c1-29(2)17-18-30(20-21-9-5-3-6-10-21)27(33)26-19-25(22-11-7-4-8-12-22)28-31(26)23-13-15-24(16-14-23)32(34)35/h3-16,19H,17-18,20H2,1-2H3