2-methoxyethyl 4-[[2,5-bis(chloranyl)phenyl]carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl 4-[[2,5-bis(chloranyl)phenyl]carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl 4-[(2,5-dichlorophenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[(2,5-dichloroanilino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[(2,5-dichlorophenyl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[(2,5-dichlorophenyl)thiocarbamoylamino]-4-keto-butyric acid 2-methoxyethyl ester Formula: C14H16Cl2N2O4S MolecularWeight: 379.25884

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)CCC(=O)NC(=S)NC1=C(C=CC(=C1)Cl)Cl

Isomeric SMILES

COCCOC(=O)CCC(=O)NC(=S)NC1=C(C=CC(=C1)Cl)Cl

InChI

InChI=1S/C14H16Cl2N2O4S/c1-21-6-7-22-13(20)5-4-12(19)18-14(23)17-11-8-9(15)2-3-10(11)16/h2-3,8H,4-7H2,1H3,(H2,17,18,19,23)