4-[2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 4-[2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 4-[2-(ethylcarbamoylamino)-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 4-[[2-(ethylcarbamoylamino)-2-oxoethyl]thio]benzoic acid IUPAC Name: 4-[2-(ethylcarbamoylamino)-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 4-[[2-(ethylcarbamoylamino)-2-keto-ethyl]thio]benzoic acid Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)CSC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCNC(=O)NC(=O)CSC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C12H14N2O4S/c1-2-13-12(18)14-10(15)7-19-9-5-3-8(4-6-9)11(16)17/h3-6H,2,7H2,1H3,(H,16,17)(H2,13,14,15,18)