[5-[(4-carboxy-5-methyl-furan-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-(phenylmethyl)azanide

Systemtic Name: [5-[(4-carboxy-5-methyl-furan-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-(phenylmethyl)azanide Openeye Name: benzyl-[5-[(4-carboxy-5-methyl-2-furyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]azanide CAS Name: [5-[(4-carboxy-5-methyl-2-furanyl)methylthio]-1,3,4-thiadiazol-2-yl]-(phenylmethyl)azanide IUPAC Name: benzyl-[5-[(4-carboxy-5-methylfuran-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]azanide Traditional Name: benzyl-[5-[(4-carboxy-5-methyl-2-furyl)methylthio]-1,3,4-thiadiazol-2-yl]azanide Formula: C16H14N3O3S2- MolecularWeight: 360.43066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NN=C(S2)[N-]CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NN=C(S2)[N-]CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C16H15N3O3S2/c1-10-13(14(20)21)7-12(22-10)9-23-16-19-18-15(24-16)17-8-11-5-3-2-4-6-11/h2-7H,8-9H2,1H3,(H2,17,18,20,21)/p-1