5-[[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylamino]methyl]-2-methoxy-benzoate

Systemtic Name: 5-[[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylamino]methyl]-2-methoxy-benzoate Openeye Name: 5-[[[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[2-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]amino]methyl]-2-methoxybenzoate IUPAC Name: 5-[[[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]methyl]-2-methoxybenzoate Traditional Name: 5-[[[2-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]thio]acetyl]amino]methyl]-2-methoxy-benzoate Formula: C15H16N3O4S3- MolecularWeight: 398.50024

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)SCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)[O-]

Isomeric SMILES

CCSC1=NN=C(S1)SCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)[O-]

InChI

InChI=1S/C15H17N3O4S3/c1-3-23-14-17-18-15(25-14)24-8-12(19)16-7-9-4-5-11(22-2)10(6-9)13(20)21/h4-6H,3,7-8H2,1-2H3,(H,16,19)(H,20,21)/p-1