(2R)-N-methoxy-N-methyl-3-oxidanyl-2-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-sulfanyl-methyl]amino]propanamide

Systemtic Name: (2R)-N-methoxy-N-methyl-3-oxidanyl-2-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-sulfanyl-methyl]amino]propanamide Openeye Name: (2R)-3-hydroxy-N-methoxy-N-methyl-2-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)-sulfanyl-methyl]amino]propanamide CAS Name: (2R)-3-hydroxy-2-[[(E)-mercapto-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-N-methoxy-N-methylpropanamide IUPAC Name: (2R)-3-hydroxy-N-methoxy-N-methyl-2-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)-sulfanylmethyl]amino]propanamide Traditional Name: (2R)-3-hydroxy-2-[[(E)-(6-ketocyclohexa-2,4-dien-1-ylidene)-mercapto-methyl]amino]-N-methoxy-N-methyl-propionamide Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C(CO)NC(=C1C=CC=CC1=O)S)OC

Isomeric SMILES

CN(C(=O)[C@@H](CO)N/C(=C\1/C=CC=CC1=O)/S)OC

InChI

InChI=1S/C12H16N2O4S/c1-14(18-2)12(17)9(7-15)13-11(19)8-5-3-4-6-10(8)16/h3-6,9,13,15,19H,7H2,1-2H3/b11-8+/t9-/m1/s1