propyl 4-[[2,3-bis(chloranyl)phenyl]carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: propyl 4-[[2,3-bis(chloranyl)phenyl]carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: propyl 4-[(2,3-dichlorophenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[(2,3-dichloroanilino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-[(2,3-dichlorophenyl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[(2,3-dichlorophenyl)thiocarbamoylamino]-4-keto-butyric acid propyl ester Formula: C14H16Cl2N2O3S MolecularWeight: 363.25944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16Cl2N2O3S/c1-2-8-21-12(20)7-6-11(19)18-14(22)17-10-5-3-4-9(15)13(10)16/h3-5H,2,6-8H2,1H3,(H2,17,18,19,22)