ethyl 4-[[5-[(4-methylphenyl)carbamoylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[5-[(4-methylphenyl)carbamoylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxidanylidene-butanoate Openeye Name: ethyl 3-oxo-4-[[5-(p-tolylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanoate CAS Name: 4-[[5-[[(4-methylanilino)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[5-[(4-methylphenyl)carbamoylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxobutanoate Traditional Name: 3-keto-4-[[5-(p-tolylcarbamoylamino)-1,3,4-thiadiazol-2-yl]thio]butyric acid ethyl ester Formula: C16H18N4O4S2 MolecularWeight: 394.46852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=NN=C(S1)NC(=O)NC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=NN=C(S1)NC(=O)NC2=CC=C(C=C2)C

InChI

InChI=1S/C16H18N4O4S2/c1-3-24-13(22)8-12(21)9-25-16-20-19-15(26-16)18-14(23)17-11-6-4-10(2)5-7-11/h4-7H,3,8-9H2,1-2H3,(H2,17,18,19,23)