ethyl 3-(ethanoylcarbamothioylamino)-4-morpholin-4-yl-benzoate

Systemtic Name: ethyl 3-(ethanoylcarbamothioylamino)-4-morpholin-4-yl-benzoate Openeye Name: ethyl 3-(acetylcarbamothioylamino)-4-morpholino-benzoate CAS Name: 3-[[acetamido(sulfanylidene)methyl]amino]-4-(4-morpholinyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-(acetylcarbamothioylamino)-4-morpholin-4-ylbenzoate Traditional Name: 3-(acetylthiocarbamoylamino)-4-morpholino-benzoic acid ethyl ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=S)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=S)NC(=O)C

InChI

InChI=1S/C16H21N3O4S/c1-3-23-15(21)12-4-5-14(19-6-8-22-9-7-19)13(10-12)18-16(24)17-11(2)20/h4-5,10H,3,6-9H2,1-2H3,(H2,17,18,20,24)