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

Systemtic Name: methyl 4-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate Openeye Name: methyl 4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate CAS Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)thio]butanoic acid methyl ester IUPAC Name: methyl 4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate Traditional Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)thio]butyric acid methyl ester Formula: C7H11N3O2S2 MolecularWeight: 233.31114

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC1=NN=C(S1)N

Isomeric SMILES

COC(=O)CCCSC1=NN=C(S1)N

InChI

InChI=1S/C7H11N3O2S2/c1-12-5(11)3-2-4-13-7-10-9-6(8)14-7/h2-4H2,1H3,(H2,8,9)