methyl 2-[[4-(4-thiophen-2-ylbutanoylamino)phenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[4-(4-thiophen-2-ylbutanoylamino)phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[4-[4-(2-thienyl)butanoylamino]benzoyl]amino]acetate CAS Name: 2-[[oxo-[4-[(1-oxo-4-thiophen-2-ylbutyl)amino]phenyl]methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-(4-thiophen-2-ylbutanoylamino)benzoyl]amino]acetate Traditional Name: 2-[[4-[4-(2-thienyl)butanoylamino]benzoyl]amino]acetic acid methyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)CCCC2=CC=CS2

Isomeric SMILES

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)CCCC2=CC=CS2

InChI

InChI=1S/C18H20N2O4S/c1-24-17(22)12-19-18(23)13-7-9-14(10-8-13)20-16(21)6-2-4-15-5-3-11-25-15/h3,5,7-11H,2,4,6,12H2,1H3,(H,19,23)(H,20,21)