(4-oxidanylidene-4-thiophen-2-yl-butyl) 2-[(3,4-dimethylphenyl)carbonylamino]ethanoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 2-[(3,4-dimethylphenyl)carbonylamino]ethanoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 2-[(3,4-dimethylbenzoyl)amino]acetate CAS Name: 2-[[(3,4-dimethylphenyl)-oxomethyl]amino]acetic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 2-[(3,4-dimethylbenzoyl)amino]acetate Traditional Name: 2-[(3,4-dimethylbenzoyl)amino]acetic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCCCC(=O)C2=CC=CS2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCCCC(=O)C2=CC=CS2)C

InChI

InChI=1S/C19H21NO4S/c1-13-7-8-15(11-14(13)2)19(23)20-12-18(22)24-9-3-5-16(21)17-6-4-10-25-17/h4,6-8,10-11H,3,5,9,12H2,1-2H3,(H,20,23)