[1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 2-(3,4-dimethylphenyl)ethanoate

Systemtic Name: [1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 2-(3,4-dimethylphenyl)ethanoate Openeye Name: [1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] 2-(3,4-dimethylphenyl)acetate CAS Name: 2-(3,4-dimethylphenyl)acetic acid [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 2-(3,4-dimethylphenyl)acetate Traditional Name: 2-(3,4-dimethylphenyl)acetic acid [2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC(=O)OC(C)C(=O)NCC2=CC=CS2)C

Isomeric SMILES

CC1=C(C=C(C=C1)CC(=O)OC(C)C(=O)NCC2=CC=CS2)C

InChI

InChI=1S/C18H21NO3S/c1-12-6-7-15(9-13(12)2)10-17(20)22-14(3)18(21)19-11-16-5-4-8-23-16/h4-9,14H,10-11H2,1-3H3,(H,19,21)