5-butyl-4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-methyl-1-(3-morpholin-4-ylpropyl)pyrrole-3-carboxamide

Systemtic Name: 5-butyl-4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-methyl-1-(3-morpholin-4-ylpropyl)pyrrole-3-carboxamide Openeye Name: 5-butyl-4-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-methyl-1-(3-morpholinopropyl)pyrrole-3-carboxamide CAS Name: 5-butyl-4-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-methyl-1-[3-(4-morpholinyl)propyl]-3-pyrrolecarboxamide IUPAC Name: 5-butyl-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-methyl-1-(3-morpholin-4-ylpropyl)pyrrole-3-carboxamide Traditional Name: 5-butyl-4-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-methyl-1-(3-morpholinopropyl)pyrrole-3-carboxamide Formula: C28H39N5O3 MolecularWeight: 493.64096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCCN2CCOCC2)C)C(=O)N)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCCCC1=C(C(=C(N1CCCN2CCOCC2)C)C(=O)N)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C28H39N5O3/c1-5-6-13-23-26(25-20(2)30(4)33(28(25)35)22-11-8-7-9-12-22)24(27(29)34)21(3)32(23)15-10-14-31-16-18-36-19-17-31/h7-9,11-12H,5-6,10,13-19H2,1-4H3,(H2,29,34)