ethyl 4-[(4,5,7-trimethyl-6-oxidanyl-1,3-benzothiazol-2-yl)amino]butanoate

Systemtic Name: ethyl 4-[(4,5,7-trimethyl-6-oxidanyl-1,3-benzothiazol-2-yl)amino]butanoate Openeye Name: ethyl 4-[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]butanoate CAS Name: 4-[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]butanoate Traditional Name: 4-[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]butyric acid ethyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC1=NC2=C(S1)C(=C(C(=C2C)C)O)C

Isomeric SMILES

CCOC(=O)CCCNC1=NC2=C(S1)C(=C(C(=C2C)C)O)C

InChI

InChI=1S/C16H22N2O3S/c1-5-21-12(19)7-6-8-17-16-18-13-9(2)10(3)14(20)11(4)15(13)22-16/h20H,5-8H2,1-4H3,(H,17,18)