[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl 2-(1-adamantylcarbonylamino)ethanoate

Systemtic Name: [2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl 2-(1-adamantylcarbonylamino)ethanoate Openeye Name: [2-(2-chlorophenyl)thiazol-4-yl]methyl 2-(adamantane-1-carbonylamino)acetate CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]acetic acid [2-(2-chlorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl 2-(adamantane-1-carbonylamino)acetate Traditional Name: 2-(adamantane-1-carbonylamino)acetic acid [2-(2-chlorophenyl)thiazol-4-yl]methyl ester Formula: C23H25ClN2O3S MolecularWeight: 444.9742

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)OCC4=CSC(=N4)C5=CC=CC=C5Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)OCC4=CSC(=N4)C5=CC=CC=C5Cl

InChI

InChI=1S/C23H25ClN2O3S/c24-19-4-2-1-3-18(19)21-26-17(13-30-21)12-29-20(27)11-25-22(28)23-8-14-5-15(9-23)7-16(6-14)10-23/h1-4,13-16H,5-12H2,(H,25,28)