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

Systemtic Name: 2-[[5-[(Z)-N-(furan-2-ylcarbonylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[5-[(Z)-N-(furan-2-carbonylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methylsulfanyl]acetic acid CAS Name: 2-[[5-[(1Z)-1-[[2-furanyl(oxo)methyl]hydrazinylidene]ethyl]-2-methoxyphenyl]methylthio]acetic acid IUPAC Name: 2-[[5-[(Z)-N-(furan-2-carbonylamino)-C-methylcarbonimidoyl]-2-methoxyphenyl]methylsulfanyl]acetic acid Traditional Name: 2-[[5-[(Z)-N-(2-furoylamino)-C-methyl-carbonimidoyl]-2-methoxy-benzyl]thio]acetic acid Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CO1)C2=CC(=C(C=C2)OC)CSCC(=O)O

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=CO1)/C2=CC(=C(C=C2)OC)CSCC(=O)O

InChI

InChI=1S/C17H18N2O5S/c1-11(18-19-17(22)15-4-3-7-24-15)12-5-6-14(23-2)13(8-12)9-25-10-16(20)21/h3-8H,9-10H2,1-2H3,(H,19,22)(H,20,21)/b18-11-