methyl 2-(propanoylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-(propanoylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(propanoylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylate CAS Name: 2-(1-oxopropylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(propanoylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylate Traditional Name: 2-propionamido-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC2=C(S1)CC(CC2)C(=O)OC

Isomeric SMILES

CCC(=O)NC1=NC2=C(S1)CC(CC2)C(=O)OC

InChI

InChI=1S/C12H16N2O3S/c1-3-10(15)14-12-13-8-5-4-7(11(16)17-2)6-9(8)18-12/h7H,3-6H2,1-2H3,(H,13,14,15)