N-[3-[1-cyclopropyl-1-[2-oxidanyl-4-oxidanylidene-6-(1-phenylbutan-2-yl)pyran-3-yl]ethyl]phenyl]pyrazole-1-sulfonamide

Systemtic Name: N-[3-[1-cyclopropyl-1-[2-oxidanyl-4-oxidanylidene-6-(1-phenylbutan-2-yl)pyran-3-yl]ethyl]phenyl]pyrazole-1-sulfonamide Openeye Name: N-[3-[1-[6-(1-benzylpropyl)-2-hydroxy-4-oxo-pyran-3-yl]-1-cyclopropyl-ethyl]phenyl]pyrazole-1-sulfonamide CAS Name: N-[3-[1-cyclopropyl-1-[2-hydroxy-4-oxo-6-(1-phenylbutan-2-yl)-3-pyranyl]ethyl]phenyl]-1-pyrazolesulfonamide IUPAC Name: N-[3-[1-cyclopropyl-1-[2-hydroxy-4-oxo-6-(1-phenylbutan-2-yl)pyran-3-yl]ethyl]phenyl]pyrazole-1-sulfonamide Traditional Name: N-[3-[1-[6-(1-benzylpropyl)-2-hydroxy-4-keto-pyran-3-yl]-1-cyclopropyl-ethyl]phenyl]pyrazole-1-sulfonamide Formula: C29H31N3O5S MolecularWeight: 533.63854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)C2=CC(=O)C(=C(O2)O)C(C)(C3CC3)C4=CC(=CC=C4)NS(=O)(=O)N5C=CC=N5

Isomeric SMILES

CCC(CC1=CC=CC=C1)C2=CC(=O)C(=C(O2)O)C(C)(C3CC3)C4=CC(=CC=C4)NS(=O)(=O)N5C=CC=N5

InChI

InChI=1S/C29H31N3O5S/c1-3-21(17-20-9-5-4-6-10-20)26-19-25(33)27(28(34)37-26)29(2,22-13-14-22)23-11-7-12-24(18-23)31-38(35,36)32-16-8-15-30-32/h4-12,15-16,18-19,21-22,31,34H,3,13-14,17H2,1-2H3