ethyl 3-[(2,4-dichlorophenyl)carbonylcarbamothioylamino]-4-morpholin-4-yl-benzoate

Systemtic Name: ethyl 3-[(2,4-dichlorophenyl)carbonylcarbamothioylamino]-4-morpholin-4-yl-benzoate Openeye Name: ethyl 3-[(2,4-dichlorobenzoyl)carbamothioylamino]-4-morpholino-benzoate CAS Name: 3-[[[[(2,4-dichlorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-(4-morpholinyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-[(2,4-dichlorobenzoyl)carbamothioylamino]-4-morpholin-4-ylbenzoate Traditional Name: 3-[(2,4-dichlorobenzoyl)thiocarbamoylamino]-4-morpholino-benzoic acid ethyl ester Formula: C21H21Cl2N3O4S MolecularWeight: 482.38014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21Cl2N3O4S/c1-2-30-20(28)13-3-6-18(26-7-9-29-10-8-26)17(11-13)24-21(31)25-19(27)15-5-4-14(22)12-16(15)23/h3-6,11-12H,2,7-10H2,1H3,(H2,24,25,27,31)