ethyl 4-[2-[[5-[(2,3-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-[[5-[(2,3-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoylamino]butanoate Openeye Name: ethyl 4-[[2-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]butanoate CAS Name: 4-[[2-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]butanoate Traditional Name: 4-[[2-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]acetyl]amino]butyric acid ethyl ester Formula: C18H24N4O3S2 MolecularWeight: 408.53816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=NN=C(S1)NC2=CC=CC(=C2C)C

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=NN=C(S1)NC2=CC=CC(=C2C)C

InChI

InChI=1S/C18H24N4O3S2/c1-4-25-16(24)9-6-10-19-15(23)11-26-18-22-21-17(27-18)20-14-8-5-7-12(2)13(14)3/h5,7-8H,4,6,9-11H2,1-3H3,(H,19,23)(H,20,21)