[1-oxidanylidene-1-(phenylcarbamoylamino)propan-2-yl] 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoate

Systemtic Name: [1-oxidanylidene-1-(phenylcarbamoylamino)propan-2-yl] 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoate Openeye Name: [1-methyl-2-oxo-2-(phenylcarbamoylamino)ethyl] 2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetate CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]acetic acid [1-[[anilino(oxo)methyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-oxo-1-(phenylcarbamoylamino)propan-2-yl] 2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetate Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]acetic acid [2-keto-1-methyl-2-(phenylcarbamoylamino)ethyl] ester Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC=CC=C1)OC(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC(C(=O)NC(=O)NC1=CC=CC=C1)OC(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C17H17N3O5S/c1-12(16(22)19-17(23)18-13-7-3-2-4-8-13)25-15(21)11-26-14-9-5-6-10-20(14)24/h2-10,12H,11H2,1H3,(H2,18,19,22,23)