hexyl 2-azanyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: hexyl 2-azanyl-1,3-benzothiazole-6-carboxylate Openeye Name: hexyl 2-amino-1,3-benzothiazole-6-carboxylate CAS Name: 2-amino-1,3-benzothiazole-6-carboxylic acid hexyl ester IUPAC Name: hexyl 2-amino-1,3-benzothiazole-6-carboxylate Traditional Name: 2-amino-1,3-benzothiazole-6-carboxylic acid hexyl ester Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)N

Isomeric SMILES

CCCCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)N

InChI

InChI=1S/C14H18N2O2S/c1-2-3-4-5-8-18-13(17)10-6-7-11-12(9-10)19-14(15)16-11/h6-7,9H,2-5,8H2,1H3,(H2,15,16)