methyl 3-[(7-azanyl-2,1,3-benzoxadiazol-4-yl)sulfanyl]propanoate

Systemtic Name: methyl 3-[(7-azanyl-2,1,3-benzoxadiazol-4-yl)sulfanyl]propanoate Openeye Name: methyl 3-[(7-amino-2,1,3-benzoxadiazol-4-yl)sulfanyl]propanoate CAS Name: 3-[(7-amino-2,1,3-benzoxadiazol-4-yl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-[(7-amino-2,1,3-benzoxadiazol-4-yl)sulfanyl]propanoate Traditional Name: 3-[(7-aminobenzofurazan-4-yl)thio]propionic acid methyl ester Formula: C10H11N3O3S MolecularWeight: 253.27764

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=CC=C(C2=NON=C12)N

Isomeric SMILES

COC(=O)CCSC1=CC=C(C2=NON=C12)N

InChI

InChI=1S/C10H11N3O3S/c1-15-8(14)4-5-17-7-3-2-6(11)9-10(7)13-16-12-9/h2-3H,4-5,11H2,1H3