methyl 2-acetamido-2-(2-azanyl-1,3-benzothiazol-6-yl)ethanoate

Systemtic Name: methyl 2-acetamido-2-(2-azanyl-1,3-benzothiazol-6-yl)ethanoate Openeye Name: methyl 2-acetamido-2-(2-amino-1,3-benzothiazol-6-yl)acetate CAS Name: 2-acetamido-2-(2-amino-1,3-benzothiazol-6-yl)acetic acid methyl ester IUPAC Name: methyl 2-acetamido-2-(2-amino-1,3-benzothiazol-6-yl)acetate Traditional Name: 2-acetamido-2-(2-amino-1,3-benzothiazol-6-yl)acetic acid methyl ester Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1=CC2=C(C=C1)N=C(S2)N)C(=O)OC

Isomeric SMILES

CC(=O)NC(C1=CC2=C(C=C1)N=C(S2)N)C(=O)OC

InChI

InChI=1S/C12H13N3O3S/c1-6(16)14-10(11(17)18-2)7-3-4-8-9(5-7)19-12(13)15-8/h3-5,10H,1-2H3,(H2,13,15)(H,14,16)