N-[[5-[cyclopropyl-[2-oxidanyl-4-oxidanylidene-6-(1-phenylbutan-2-yl)pyran-3-yl]methyl]thiophen-2-yl]methyl]benzenesulfonamide

Systemtic Name: N-[[5-[cyclopropyl-[2-oxidanyl-4-oxidanylidene-6-(1-phenylbutan-2-yl)pyran-3-yl]methyl]thiophen-2-yl]methyl]benzenesulfonamide Openeye Name: N-[[5-[[6-(1-benzylpropyl)-2-hydroxy-4-oxo-pyran-3-yl]-cyclopropyl-methyl]-2-thienyl]methyl]benzenesulfonamide CAS Name: N-[[5-[cyclopropyl-[2-hydroxy-4-oxo-6-(1-phenylbutan-2-yl)-3-pyranyl]methyl]-2-thiophenyl]methyl]benzenesulfonamide IUPAC Name: N-[[5-[cyclopropyl-[2-hydroxy-4-oxo-6-(1-phenylbutan-2-yl)pyran-3-yl]methyl]thiophen-2-yl]methyl]benzenesulfonamide Traditional Name: N-[[5-[[6-(1-benzylpropyl)-2-hydroxy-4-keto-pyran-3-yl]-cyclopropyl-methyl]-2-thienyl]methyl]benzenesulfonamide Formula: C30H31NO5S2 MolecularWeight: 549.70084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC=C(S4)CNS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCC(CC1=CC=CC=C1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC=C(S4)CNS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H31NO5S2/c1-2-21(17-20-9-5-3-6-10-20)26-18-25(32)29(30(33)36-26)28(22-13-14-22)27-16-15-23(37-27)19-31-38(34,35)24-11-7-4-8-12-24/h3-12,15-16,18,21-22,28,31,33H,2,13-14,17,19H2,1H3