ethyl 2-[[(2-ethoxyphenyl)methyl-(3-morpholin-4-ylpropyl)carbamothioyl]amino]ethanoate

Systemtic Name: ethyl 2-[[(2-ethoxyphenyl)methyl-(3-morpholin-4-ylpropyl)carbamothioyl]amino]ethanoate Openeye Name: ethyl 2-[[(2-ethoxyphenyl)methyl-(3-morpholinopropyl)carbamothioyl]amino]acetate CAS Name: 2-[[[(2-ethoxyphenyl)methyl-[3-(4-morpholinyl)propyl]amino]-sulfanylidenemethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(2-ethoxyphenyl)methyl-(3-morpholin-4-ylpropyl)carbamothioyl]amino]acetate Traditional Name: 2-[[(2-ethoxybenzyl)-(3-morpholinopropyl)thiocarbamoyl]amino]acetic acid ethyl ester Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN(CCCN2CCOCC2)C(=S)NCC(=O)OCC

Isomeric SMILES

CCOC1=CC=CC=C1CN(CCCN2CCOCC2)C(=S)NCC(=O)OCC

InChI

InChI=1S/C21H33N3O4S/c1-3-27-19-9-6-5-8-18(19)17-24(21(29)22-16-20(25)28-4-2)11-7-10-23-12-14-26-15-13-23/h5-6,8-9H,3-4,7,10-17H2,1-2H3,(H,22,29)