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

Systemtic Name: N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)-N-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: N-benzyl-N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)-N-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-benzyl-N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-benzyl-N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C29H31N5O3 MolecularWeight: 497.58814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N(CCN(C)C)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N(CCN(C)C)CC4=CC=CC=C4)C

InChI

InChI=1S/C29H31N5O3/c1-21-10-15-27(22(2)18-21)33-28(19-26(30-33)24-11-13-25(14-12-24)34(36)37)29(35)32(17-16-31(3)4)20-23-8-6-5-7-9-23/h5-15,18-19H,16-17,20H2,1-4H3