methyl 4-[[5-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[5-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[5-(2-ethoxy-2-oxo-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]carbamoyl]benzoate CAS Name: 4-[[[5-[(2-ethoxy-2-oxoethyl)thio]-1,3,4-thiadiazol-2-yl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(2-ethoxy-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]carbamoyl]benzoate Traditional Name: 4-[[5-[(2-ethoxy-2-keto-ethyl)thio]-1,3,4-thiadiazol-2-yl]carbamoyl]benzoic acid methyl ester Formula: C15H15N3O5S2 MolecularWeight: 381.4267

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N3O5S2/c1-3-23-11(19)8-24-15-18-17-14(25-15)16-12(20)9-4-6-10(7-5-9)13(21)22-2/h4-7H,3,8H2,1-2H3,(H,16,17,20)