2-methoxyethyl 4-[(3-chloranyl-4-methoxy-phenyl)carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl 4-[(3-chloranyl-4-methoxy-phenyl)carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl 4-[(3-chloro-4-methoxy-phenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[(3-chloro-4-methoxyanilino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[(3-chloro-4-methoxyphenyl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[(3-chloro-4-methoxy-phenyl)thiocarbamoylamino]-4-keto-butyric acid 2-methoxyethyl ester Formula: C15H19ClN2O5S MolecularWeight: 374.83976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19ClN2O5S/c1-21-7-8-23-14(20)6-5-13(19)18-15(24)17-10-3-4-12(22-2)11(16)9-10/h3-4,9H,5-8H2,1-2H3,(H2,17,18,19,24)