1-methyl-3-[4-(methylamino)-5-oxidanyl-2-oxidanylsulfanyl-phenyl]urea

Systemtic Name: 1-methyl-3-[4-(methylamino)-5-oxidanyl-2-oxidanylsulfanyl-phenyl]urea Openeye Name: 1-[5-hydroxy-2-hydroxysulfanyl-4-(methylamino)phenyl]-3-methyl-urea CAS Name: 4-hydroxy-5-(methylamino)-2-(methylcarbamoylamino)benzenesulfenic acid IUPAC Name: 1-[5-hydroxy-2-hydroxysulfanyl-4-(methylamino)phenyl]-3-methylurea Traditional Name: 1-[5-hydroxy-4-(methylamino)-2-sulfeno-phenyl]-3-methyl-urea Formula: C9H13N3O3S MolecularWeight: 243.28282

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C(=C1)SO)NC(=O)NC)O

Isomeric SMILES

CNC1=C(C=C(C(=C1)SO)NC(=O)NC)O

InChI

InChI=1S/C9H13N3O3S/c1-10-5-4-8(16-15)6(3-7(5)13)12-9(14)11-2/h3-4,10,13,15H,1-2H3,(H2,11,12,14)