(5E)-5-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-N-(4-morpholin-4-ylsulfonylphenyl)-1,2-dihydropyrazole-3-carboxamide

Systemtic Name: (5E)-5-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-N-(4-morpholin-4-ylsulfonylphenyl)-1,2-dihydropyrazole-3-carboxamide Openeye Name: (5E)-5-(5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-N-(4-morpholinosulfonylphenyl)-1,2-dihydropyrazole-3-carboxamide CAS Name: (5E)-5-(5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-N-[4-(4-morpholinylsulfonyl)phenyl]-1,2-dihydropyrazole-3-carboxamide IUPAC Name: (5E)-5-(5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-(4-morpholin-4-ylsulfonylphenyl)-1,2-dihydropyrazole-3-carboxamide Traditional Name: (5E)-5-(6-keto-5-methyl-cyclohexa-2,4-dien-1-ylidene)-N-(4-morpholinosulfonylphenyl)-3-pyrazoline-3-carboxamide Formula: C21H22N4O5S MolecularWeight: 442.48818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C2C=C(NN2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C1=O

Isomeric SMILES

CC1=CC=C/C(=C\2/C=C(NN2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)/C1=O

InChI

InChI=1S/C21H22N4O5S/c1-14-3-2-4-17(20(14)26)18-13-19(24-23-18)21(27)22-15-5-7-16(8-6-15)31(28,29)25-9-11-30-12-10-25/h2-8,13,23-24H,9-12H2,1H3,(H,22,27)/b18-17+