ethyl 2-(1-adamantylcarbonylamino)-4-thiophen-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(1-adamantylcarbonylamino)-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-(adamantane-1-carbonylamino)-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(adamantane-1-carbonylamino)-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-(adamantane-1-carbonylamino)-4-(2-thienyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H25NO3S2 MolecularWeight: 415.5688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H25NO3S2/c1-2-26-20(24)18-16(17-4-3-5-27-17)12-28-19(18)23-21(25)22-9-13-6-14(10-22)8-15(7-13)11-22/h3-5,12-15H,2,6-11H2,1H3,(H,23,25)