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

Systemtic Name: (4-cyanophenyl)methyl 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoate Openeye Name: (4-cyanophenyl)methyl 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 (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 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 (4-cyanobenzyl) ester Formula: C12H10N4O2S2 MolecularWeight: 306.3634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CSC2=NN=C(S2)N)C#N

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CSC2=NN=C(S2)N)C#N

InChI

InChI=1S/C12H10N4O2S2/c13-5-8-1-3-9(4-2-8)6-18-10(17)7-19-12-16-15-11(14)20-12/h1-4H,6-7H2,(H2,14,15)