methyl 2-[2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[1-oxo-2-[[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]thio]ethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]acetate Traditional Name: 2-[[2-[[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]thio]acetyl]amino]acetic acid methyl ester Formula: C15H15N3O4S3 MolecularWeight: 397.4923

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CSC1=NN=C(S1)SCC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CNC(=O)CSC1=NN=C(S1)SCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H15N3O4S3/c1-22-13(21)7-16-12(20)9-24-15-18-17-14(25-15)23-8-11(19)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,16,20)