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

Systemtic Name: ethyl 2-[[(3-methylphenyl)methyl-(3-morpholin-4-ylpropyl)carbamothioyl]amino]ethanoate Openeye Name: ethyl 2-[[3-morpholinopropyl(m-tolylmethyl)carbamothioyl]amino]acetate CAS Name: 2-[[[(3-methylphenyl)methyl-[3-(4-morpholinyl)propyl]amino]-sulfanylidenemethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(3-methylphenyl)methyl-(3-morpholin-4-ylpropyl)carbamothioyl]amino]acetate Traditional Name: 2-[[(3-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(=C2)C

Isomeric SMILES

CCOC(=O)CNC(=S)N(CCCN1CCOCC1)CC2=CC=CC(=C2)C

InChI

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