2-[2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-(cyclopropylcarbamoylamino)-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-[[(cyclopropylamino)-oxomethyl]amino]-2-oxoethyl]thio]benzoic acid IUPAC Name: 2-[2-(cyclopropylcarbamoylamino)-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-(cyclopropylcarbamoylamino)-2-keto-ethyl]thio]benzoic acid Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC(=O)CSC2=CC=CC=C2C(=O)O

Isomeric SMILES

C1CC1NC(=O)NC(=O)CSC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C13H14N2O4S/c16-11(15-13(19)14-8-5-6-8)7-20-10-4-2-1-3-9(10)12(17)18/h1-4,8H,5-7H2,(H,17,18)(H2,14,15,16,19)