[(2S)-butan-2-yl] 2-azanyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: [(2S)-butan-2-yl] 2-azanyl-1,3-benzothiazole-6-carboxylate Openeye Name: [(1S)-1-methylpropyl] 2-amino-1,3-benzothiazole-6-carboxylate CAS Name: 2-amino-1,3-benzothiazole-6-carboxylic acid [(2S)-butan-2-yl] ester IUPAC Name: [(2S)-butan-2-yl] 2-amino-1,3-benzothiazole-6-carboxylate Traditional Name: 2-amino-1,3-benzothiazole-6-carboxylic acid [(1S)-1-methylpropyl] ester Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)N

Isomeric SMILES

CC[C@H](C)OC(=O)C1=CC2=C(C=C1)N=C(S2)N

InChI

InChI=1S/C12H14N2O2S/c1-3-7(2)16-11(15)8-4-5-9-10(6-8)17-12(13)14-9/h4-7H,3H2,1-2H3,(H2,13,14)/t7-/m0/s1