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

Systemtic Name: propan-2-yl 4-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]thio]acetyl]amino]benzoic acid isopropyl ester Formula: C16H19N3O3S3 MolecularWeight: 397.53536

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C

Isomeric SMILES

CCSC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C

InChI

InChI=1S/C16H19N3O3S3/c1-4-23-15-18-19-16(25-15)24-9-13(20)17-12-7-5-11(6-8-12)14(21)22-10(2)3/h5-8,10H,4,9H2,1-3H3,(H,17,20)