5-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-methyl-pyrrole-3-carboxamide

Systemtic Name: 5-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-methyl-pyrrole-3-carboxamide Openeye Name: 5-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-methyl-pyrrole-3-carboxamide CAS Name: 5-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-methyl-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-methylpyrrole-3-carboxamide Traditional Name: 5-butyl-1-homoveratryl-4-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-methyl-pyrrole-3-carboxamide Formula: C31H38N4O4 MolecularWeight: 530.65782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCCCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C31H38N4O4/c1-7-8-14-24-29(28-20(2)33(4)35(31(28)37)23-12-10-9-11-13-23)27(30(32)36)21(3)34(24)18-17-22-15-16-25(38-5)26(19-22)39-6/h9-13,15-16,19H,7-8,14,17-18H2,1-6H3,(H2,32,36)