[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 1,3-benzothiazole-6-carboxylate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 1,3-benzothiazole-6-carboxylate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)COC(=O)C1=CC2=C(C=C1)N=CS2

Isomeric SMILES

CC(C)CCNC(=O)COC(=O)C1=CC2=C(C=C1)N=CS2

InChI

InChI=1S/C15H18N2O3S/c1-10(2)5-6-16-14(18)8-20-15(19)11-3-4-12-13(7-11)21-9-17-12/h3-4,7,9-10H,5-6,8H2,1-2H3,(H,16,18)