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

Systemtic Name: phenacyl 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoate Openeye Name: phenacyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetate CAS Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]acetic acid phenacyl ester IUPAC Name: phenacyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]acetic acid phenacyl ester Formula: C12H11N3O3S2 MolecularWeight: 309.36404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)CSC2=NN=C(S2)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)CSC2=NN=C(S2)N

InChI

InChI=1S/C12H11N3O3S2/c13-11-14-15-12(20-11)19-7-10(17)18-6-9(16)8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,13,14)