[4-cyano-3-[(4-methoxyphenyl)methylsulfanyl]-1,2-thiazol-5-yl]carbamic acid

Systemtic Name: [4-cyano-3-[(4-methoxyphenyl)methylsulfanyl]-1,2-thiazol-5-yl]carbamic acid Openeye Name: [4-cyano-3-[(4-methoxyphenyl)methylsulfanyl]isothiazol-5-yl]carbamic acid CAS Name: [4-cyano-3-[(4-methoxyphenyl)methylthio]-5-isothiazolyl]carbamic acid IUPAC Name: [4-cyano-3-[(4-methoxyphenyl)methylsulfanyl]-1,2-thiazol-5-yl]carbamic acid Traditional Name: [4-cyano-3-(p-anisylthio)isothiazol-5-yl]carbamic acid Formula: C13H11N3O3S2 MolecularWeight: 321.37474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NSC(=C2C#N)NC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NSC(=C2C#N)NC(=O)O

InChI

InChI=1S/C13H11N3O3S2/c1-19-9-4-2-8(3-5-9)7-20-12-10(6-14)11(21-16-12)15-13(17)18/h2-5,15H,7H2,1H3,(H,17,18)