(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl adamantane-2-carboxylate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl adamantane-2-carboxylate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C19H21NO2S2 MolecularWeight: 359.50554

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C(=O)OCC4=CSC(=N4)C5=CSC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C(=O)OCC4=CSC(=N4)C5=CSC=C5

InChI

InChI=1S/C19H21NO2S2/c21-19(17-14-4-11-3-12(6-14)7-15(17)5-11)22-8-16-10-24-18(20-16)13-1-2-23-9-13/h1-2,9-12,14-15,17H,3-8H2