ethyl 4-morpholin-4-yl-3-[(3,4,5-trimethoxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-morpholin-4-yl-3-[(3,4,5-trimethoxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: ethyl 4-morpholino-3-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-(4-morpholinyl)-3-[[[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-morpholin-4-yl-3-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-morpholino-3-[(3,4,5-trimethoxybenzoyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C24H29N3O7S MolecularWeight: 503.56796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=S)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=S)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C24H29N3O7S/c1-5-34-23(29)15-6-7-18(27-8-10-33-11-9-27)17(12-15)25-24(35)26-22(28)16-13-19(30-2)21(32-4)20(14-16)31-3/h6-7,12-14H,5,8-11H2,1-4H3,(H2,25,26,28,35)