ethyl 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-2-phenyl-ethanoate

Systemtic Name: ethyl 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-2-phenyl-ethanoate Openeye Name: ethyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-2-phenyl-acetate CAS Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-2-phenylacetate Traditional Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-2-phenyl-acetic acid ethyl ester Formula: C12H13N3O2S2 MolecularWeight: 295.38052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)SC2=NN=C(S2)N

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)SC2=NN=C(S2)N

InChI

InChI=1S/C12H13N3O2S2/c1-2-17-10(16)9(8-6-4-3-5-7-8)18-12-15-14-11(13)19-12/h3-7,9H,2H2,1H3,(H2,13,14)