butyl 2-(2,2-dimethylpropanoylamino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-(2,2-dimethylpropanoylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-(2,2-dimethylpropanoylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-(2,2-dimethylpropanoylamino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(pivaloylamino)-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)(C)C

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)(C)C

InChI

InChI=1S/C17H22N2O3S/c1-5-6-9-22-14(20)11-7-8-12-13(10-11)23-16(18-12)19-15(21)17(2,3)4/h7-8,10H,5-6,9H2,1-4H3,(H,18,19,21)