2-methoxyethyl 4-[(2-bromophenyl)carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl 4-[(2-bromophenyl)carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl 4-[(2-bromophenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[(2-bromoanilino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[(2-bromophenyl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[(2-bromophenyl)thiocarbamoylamino]-4-keto-butyric acid 2-methoxyethyl ester Formula: C14H17BrN2O4S MolecularWeight: 389.26478

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1Br

Isomeric SMILES

COCCOC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1Br

InChI

InChI=1S/C14H17BrN2O4S/c1-20-8-9-21-13(19)7-6-12(18)17-14(22)16-11-5-3-2-4-10(11)15/h2-5H,6-9H2,1H3,(H2,16,17,18,22)