3-(2-cyclopentyl-5-propan-2-yl-phenyl)-4-oxidanyl-2-[4-(pyridin-3-ylmethoxy)phenyl]-5-sulfanylidene-2H-pyran-6-one

Systemtic Name: 3-(2-cyclopentyl-5-propan-2-yl-phenyl)-4-oxidanyl-2-[4-(pyridin-3-ylmethoxy)phenyl]-5-sulfanylidene-2H-pyran-6-one Openeye Name: 3-(2-cyclopentyl-5-isopropyl-phenyl)-4-hydroxy-2-[4-(3-pyridylmethoxy)phenyl]-5-thioxo-2H-pyran-6-one CAS Name: 3-(2-cyclopentyl-5-propan-2-ylphenyl)-4-hydroxy-2-[4-(3-pyridinylmethoxy)phenyl]-5-sulfanylidene-2H-pyran-6-one IUPAC Name: 3-(2-cyclopentyl-5-propan-2-ylphenyl)-4-hydroxy-2-[4-(pyridin-3-ylmethoxy)phenyl]-5-sulfanylidene-2H-pyran-6-one Traditional Name: 3-(2-cyclopentyl-5-isopropyl-phenyl)-4-hydroxy-2-[4-(3-pyridylmethoxy)phenyl]-5-thioxo-2H-pyran-6-one Formula: C31H31NO4S MolecularWeight: 513.64714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)C2CCCC2)C3=C(C(=S)C(=O)OC3C4=CC=C(C=C4)OCC5=CN=CC=C5)O

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)C2CCCC2)C3=C(C(=S)C(=O)OC3C4=CC=C(C=C4)OCC5=CN=CC=C5)O

InChI

InChI=1S/C31H31NO4S/c1-19(2)23-11-14-25(21-7-3-4-8-21)26(16-23)27-28(33)30(37)31(34)36-29(27)22-9-12-24(13-10-22)35-18-20-6-5-15-32-17-20/h5-6,9-17,19,21,29,33H,3-4,7-8,18H2,1-2H3