3-[cyclopropyl(thiophen-2-yl)methyl]-2-oxidanyl-6-[[1-(thiophen-3-ylmethyl)cyclopropyl]methyl]pyran-4-one

Systemtic Name: 3-[cyclopropyl(thiophen-2-yl)methyl]-2-oxidanyl-6-[[1-(thiophen-3-ylmethyl)cyclopropyl]methyl]pyran-4-one Openeye Name: 3-[cyclopropyl(2-thienyl)methyl]-2-hydroxy-6-[[1-(3-thienylmethyl)cyclopropyl]methyl]pyran-4-one CAS Name: 3-[cyclopropyl(thiophen-2-yl)methyl]-2-hydroxy-6-[[1-(3-thiophenylmethyl)cyclopropyl]methyl]-4-pyranone IUPAC Name: 3-[cyclopropyl(thiophen-2-yl)methyl]-2-hydroxy-6-[[1-(thiophen-3-ylmethyl)cyclopropyl]methyl]pyran-4-one Traditional Name: 3-[cyclopropyl(2-thienyl)methyl]-2-hydroxy-6-[[1-(3-thenyl)cyclopropyl]methyl]pyran-4-one Formula: C22H22O3S2 MolecularWeight: 398.53828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC=CS2)C3=C(OC(=CC3=O)CC4(CC4)CC5=CSC=C5)O

Isomeric SMILES

C1CC1C(C2=CC=CS2)C3=C(OC(=CC3=O)CC4(CC4)CC5=CSC=C5)O

InChI

InChI=1S/C22H22O3S2/c23-17-10-16(12-22(6-7-22)11-14-5-9-26-13-14)25-21(24)20(17)19(15-3-4-15)18-2-1-8-27-18/h1-2,5,8-10,13,15,19,24H,3-4,6-7,11-12H2