[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl 3-acetamidoadamantane-1-carboxylate

Systemtic Name: [2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl 3-acetamidoadamantane-1-carboxylate Openeye Name: [2-(2-chlorophenyl)thiazol-4-yl]methyl 3-acetamidoadamantane-1-carboxylate CAS Name: 3-acetamido-1-adamantanecarboxylic acid [2-(2-chlorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl 3-acetamidoadamantane-1-carboxylate Traditional Name: 3-acetamidoadamantane-1-carboxylic acid [2-(2-chlorophenyl)thiazol-4-yl]methyl ester Formula: C23H25ClN2O3S MolecularWeight: 444.9742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC4=CSC(=N4)C5=CC=CC=C5Cl

Isomeric SMILES

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC4=CSC(=N4)C5=CC=CC=C5Cl

InChI

InChI=1S/C23H25ClN2O3S/c1-14(27)26-23-9-15-6-16(10-23)8-22(7-15,13-23)21(28)29-11-17-12-30-20(25-17)18-4-2-3-5-19(18)24/h2-5,12,15-16H,6-11,13H2,1H3,(H,26,27)