2-[bis(1-adamantyl)methyl]-3-ethoxy-thiophene

Systemtic Name: 2-[bis(1-adamantyl)methyl]-3-ethoxy-thiophene Openeye Name: 2-[bis(1-adamantyl)methyl]-3-ethoxy-thiophene CAS Name: 2-[bis(1-adamantyl)methyl]-3-ethoxythiophene IUPAC Name: 2-[bis(1-adamantyl)methyl]-3-ethoxythiophene Traditional Name: 2-[bis(1-adamantyl)methyl]-3-ethoxy-thiophene Formula: C27H38OS MolecularWeight: 410.65502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(SC=C1)C(C23CC4CC(C2)CC(C4)C3)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CCOC1=C(SC=C1)C(C23CC4CC(C2)CC(C4)C3)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C27H38OS/c1-2-28-23-3-4-29-24(23)25(26-11-17-5-18(12-26)7-19(6-17)13-26)27-14-20-8-21(15-27)10-22(9-20)16-27/h3-4,17-22,25H,2,5-16H2,1H3