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

Systemtic Name: ethyl 2-[[(2-methylphenyl)methyl-(3-morpholin-4-ylpropyl)carbamothioyl]amino]ethanoate Openeye Name: ethyl 2-[[3-morpholinopropyl(o-tolylmethyl)carbamothioyl]amino]acetate CAS Name: 2-[[[(2-methylphenyl)methyl-[3-(4-morpholinyl)propyl]amino]-sulfanylidenemethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(2-methylphenyl)methyl-(3-morpholin-4-ylpropyl)carbamothioyl]amino]acetate Traditional Name: 2-[[(2-methylbenzyl)-(3-morpholinopropyl)thiocarbamoyl]amino]acetic acid ethyl ester Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)N(CCCN1CCOCC1)CC2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)CNC(=S)N(CCCN1CCOCC1)CC2=CC=CC=C2C

InChI

InChI=1S/C20H31N3O3S/c1-3-26-19(24)15-21-20(27)23(16-18-8-5-4-7-17(18)2)10-6-9-22-11-13-25-14-12-22/h4-5,7-8H,3,6,9-16H2,1-2H3,(H,21,27)