ethyl 3-(3-morpholin-4-ylpropylcarbamothioylamino)benzoate

Systemtic Name: ethyl 3-(3-morpholin-4-ylpropylcarbamothioylamino)benzoate Openeye Name: ethyl 3-(3-morpholinopropylcarbamothioylamino)benzoate CAS Name: 3-[[[3-(4-morpholinyl)propylamino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-(3-morpholin-4-ylpropylcarbamothioylamino)benzoate Traditional Name: 3-(3-morpholinopropylthiocarbamoylamino)benzoic acid ethyl ester Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=S)NCCCN2CCOCC2

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=S)NCCCN2CCOCC2

InChI

InChI=1S/C17H25N3O3S/c1-2-23-16(21)14-5-3-6-15(13-14)19-17(24)18-7-4-8-20-9-11-22-12-10-20/h3,5-6,13H,2,4,7-12H2,1H3,(H2,18,19,24)