N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(1-methylpyrrol-2-yl)-N-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(1-methylpyrrol-2-yl)-N-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: N-benzyl-N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide CAS Name: N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(1-methyl-2-pyrrolyl)-N-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-benzyl-N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide Traditional Name: N-benzyl-N-(2-dimethylaminoethyl)-2-(2,4-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide Formula: C28H33N5O MolecularWeight: 455.59452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CN3C)C(=O)N(CCN(C)C)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CN3C)C(=O)N(CCN(C)C)CC4=CC=CC=C4)C

InChI

InChI=1S/C28H33N5O/c1-21-13-14-25(22(2)18-21)33-27(19-24(29-33)26-12-9-15-31(26)5)28(34)32(17-16-30(3)4)20-23-10-7-6-8-11-23/h6-15,18-19H,16-17,20H2,1-5H3