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

Systemtic Name: butyl 2-(hexanoylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-(hexanoylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-(1-oxohexylamino)-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-(hexanoylamino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(caproylamino)-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)OCCCC

Isomeric SMILES

CCCCCC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)OCCCC

InChI

InChI=1S/C18H24N2O3S/c1-3-5-7-8-16(21)20-18-19-14-10-9-13(12-15(14)24-18)17(22)23-11-6-4-2/h9-10,12H,3-8,11H2,1-2H3,(H,19,20,21)