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

Systemtic Name: 5-butyl-1-[(3-chlorophenyl)methyl]-4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-methyl-pyrrole-3-carboxamide Openeye Name: 5-butyl-1-[(3-chlorophenyl)methyl]-4-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-methyl-pyrrole-3-carboxamide CAS Name: 5-butyl-1-[(3-chlorophenyl)methyl]-4-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-methyl-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-[(3-chlorophenyl)methyl]-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-methylpyrrole-3-carboxamide Traditional Name: 5-butyl-1-(3-chlorobenzyl)-4-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-methyl-pyrrole-3-carboxamide Formula: C28H31ClN4O2 MolecularWeight: 491.02434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)C)C(=O)N)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCCCC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)C)C(=O)N)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C28H31ClN4O2/c1-5-6-15-23-26(25-18(2)31(4)33(28(25)35)22-13-8-7-9-14-22)24(27(30)34)19(3)32(23)17-20-11-10-12-21(29)16-20/h7-14,16H,5-6,15,17H2,1-4H3,(H2,30,34)