methyl 5-[2-(4-chlorophenyl)-5-methyl-1,3-thiazol-4-yl]-2,2-dimethyl-4-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[2-(4-chlorophenyl)-5-methyl-1,3-thiazol-4-yl]-2,2-dimethyl-4-oxidanylidene-pentanoate Openeye Name: methyl 5-[2-(4-chlorophenyl)-5-methyl-thiazol-4-yl]-2,2-dimethyl-4-oxo-pentanoate CAS Name: 5-[2-(4-chlorophenyl)-5-methyl-4-thiazolyl]-2,2-dimethyl-4-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[2-(4-chlorophenyl)-5-methyl-1,3-thiazol-4-yl]-2,2-dimethyl-4-oxopentanoate Traditional Name: 5-[2-(4-chlorophenyl)-5-methyl-thiazol-4-yl]-4-keto-2,2-dimethyl-valeric acid methyl ester Formula: C18H20ClNO3S MolecularWeight: 365.8743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2=CC=C(C=C2)Cl)CC(=O)CC(C)(C)C(=O)OC

Isomeric SMILES

CC1=C(N=C(S1)C2=CC=C(C=C2)Cl)CC(=O)CC(C)(C)C(=O)OC

InChI

InChI=1S/C18H20ClNO3S/c1-11-15(9-14(21)10-18(2,3)17(22)23-4)20-16(24-11)12-5-7-13(19)8-6-12/h5-8H,9-10H2,1-4H3