tert-butyl 3-[2-[2-chloranyl-4-(dimethylamino)phenyl]-4-oxidanylidene-1,3-thiazolidin-3-yl]propanoate

Systemtic Name: tert-butyl 3-[2-[2-chloranyl-4-(dimethylamino)phenyl]-4-oxidanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: tert-butyl 3-[2-[2-chloro-4-(dimethylamino)phenyl]-4-oxo-thiazolidin-3-yl]propanoate CAS Name: 3-[2-[2-chloro-4-(dimethylamino)phenyl]-4-oxo-3-thiazolidinyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-[2-chloro-4-(dimethylamino)phenyl]-4-oxo-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[2-[2-chloro-4-(dimethylamino)phenyl]-4-keto-thiazolidin-3-yl]propionic acid tert-butyl ester Formula: C18H25ClN2O3S MolecularWeight: 384.9207

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCN1C(SCC1=O)C2=C(C=C(C=C2)N(C)C)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CCN1C(SCC1=O)C2=C(C=C(C=C2)N(C)C)Cl

InChI

InChI=1S/C18H25ClN2O3S/c1-18(2,3)24-16(23)8-9-21-15(22)11-25-17(21)13-7-6-12(20(4)5)10-14(13)19/h6-7,10,17H,8-9,11H2,1-5H3