4-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfanylbenzoic acid

Systemtic Name: 4-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfanylbenzoic acid Openeye Name: 4-(1-methyl-2-oxo-2-ureido-ethyl)sulfanylbenzoic acid CAS Name: 4-[[1-(carbamoylamino)-1-oxopropan-2-yl]thio]benzoic acid IUPAC Name: 4-[1-(carbamoylamino)-1-oxopropan-2-yl]sulfanylbenzoic acid Traditional Name: 4-[(2-keto-1-methyl-2-ureido-ethyl)thio]benzoic acid Formula: C11H12N2O4S MolecularWeight: 268.28898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C11H12N2O4S/c1-6(9(14)13-11(12)17)18-8-4-2-7(3-5-8)10(15)16/h2-6H,1H3,(H,15,16)(H3,12,13,14,17)