2-[[2-methoxy-5-[(Z)-C-methyl-N-(methylcarbamothioylamino)carbonimidoyl]phenyl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-(methylcarbamothioylamino)carbonimidoyl]phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-(methylcarbamothioylamino)carbonimidoyl]phenyl]methylsulfanyl]acetic acid CAS Name: 2-[[2-methoxy-5-[(1Z)-1-[[methylamino(sulfanylidene)methyl]hydrazinylidene]ethyl]phenyl]methylthio]acetic acid IUPAC Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-(methylcarbamothioylamino)carbonimidoyl]phenyl]methylsulfanyl]acetic acid Traditional Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-(methylthiocarbamoylamino)carbonimidoyl]benzyl]thio]acetic acid Formula: C14H19N3O3S2 MolecularWeight: 341.44896

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC)C1=CC(=C(C=C1)OC)CSCC(=O)O

Isomeric SMILES

C/C(=N/NC(=S)NC)/C1=CC(=C(C=C1)OC)CSCC(=O)O

InChI

InChI=1S/C14H19N3O3S2/c1-9(16-17-14(21)15-2)10-4-5-12(20-3)11(6-10)7-22-8-13(18)19/h4-6H,7-8H2,1-3H3,(H,18,19)(H2,15,17,21)/b16-9-