bis(1-adamantyl)-(4-propan-2-yloxythiophen-2-yl)methanol

Systemtic Name: bis(1-adamantyl)-(4-propan-2-yloxythiophen-2-yl)methanol Openeye Name: bis(1-adamantyl)-(4-isopropoxy-2-thienyl)methanol CAS Name: bis(1-adamantyl)-(4-propan-2-yloxy-2-thiophenyl)methanol IUPAC Name: bis(1-adamantyl)-(4-propan-2-yloxythiophen-2-yl)methanol Traditional Name: bis(1-adamantyl)-(4-isopropoxy-2-thienyl)methanol Formula: C28H40O2S MolecularWeight: 440.681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CSC(=C1)C(C23CC4CC(C2)CC(C4)C3)(C56CC7CC(C5)CC(C7)C6)O

Isomeric SMILES

CC(C)OC1=CSC(=C1)C(C23CC4CC(C2)CC(C4)C3)(C56CC7CC(C5)CC(C7)C6)O

InChI

InChI=1S/C28H40O2S/c1-17(2)30-24-9-25(31-16-24)28(29,26-10-18-3-19(11-26)5-20(4-18)12-26)27-13-21-6-22(14-27)8-23(7-21)15-27/h9,16-23,29H,3-8,10-15H2,1-2H3