methyl 5-morpholin-4-yl-2-(4-thiophen-2-ylbutanoylamino)benzoate

Systemtic Name: methyl 5-morpholin-4-yl-2-(4-thiophen-2-ylbutanoylamino)benzoate Openeye Name: methyl 5-morpholino-2-[4-(2-thienyl)butanoylamino]benzoate CAS Name: 5-(4-morpholinyl)-2-[(1-oxo-4-thiophen-2-ylbutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 5-morpholin-4-yl-2-(4-thiophen-2-ylbutanoylamino)benzoate Traditional Name: 5-morpholino-2-[4-(2-thienyl)butanoylamino]benzoic acid methyl ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)N2CCOCC2)NC(=O)CCCC3=CC=CS3

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)N2CCOCC2)NC(=O)CCCC3=CC=CS3

InChI

InChI=1S/C20H24N2O4S/c1-25-20(24)17-14-15(22-9-11-26-12-10-22)7-8-18(17)21-19(23)6-2-4-16-5-3-13-27-16/h3,5,7-8,13-14H,2,4,6,9-12H2,1H3,(H,21,23)