ethyl 2-[2-(1-adamantyl)ethanoylamino]-4-(furan-2-yl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(1-adamantyl)ethanoylamino]-4-(furan-2-yl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(1-adamantyl)acetyl]amino]-4-(2-furyl)thiophene-3-carboxylate CAS Name: 2-[[2-(1-adamantyl)-1-oxoethyl]amino]-4-(2-furanyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1-adamantyl)acetyl]amino]-4-(furan-2-yl)thiophene-3-carboxylate Traditional Name: 2-[[2-(1-adamantyl)acetyl]amino]-4-(2-furyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H27NO4S MolecularWeight: 413.52978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H27NO4S/c1-2-27-22(26)20-17(18-4-3-5-28-18)13-29-21(20)24-19(25)12-23-9-14-6-15(10-23)8-16(7-14)11-23/h3-5,13-16H,2,6-12H2,1H3,(H,24,25)