[1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: [1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate Openeye Name: [2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 4-methyl-2-phenyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-phenyl-5-thiazolecarboxylic acid [1-(cycloheptylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cycloheptylamino)-1-oxopropan-2-yl] 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-phenyl-thiazole-5-carboxylic acid [2-(cycloheptylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)OC(C)C(=O)NC3CCCCCC3

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)OC(C)C(=O)NC3CCCCCC3

InChI

InChI=1S/C21H26N2O3S/c1-14-18(27-20(22-14)16-10-6-5-7-11-16)21(25)26-15(2)19(24)23-17-12-8-3-4-9-13-17/h5-7,10-11,15,17H,3-4,8-9,12-13H2,1-2H3,(H,23,24)