ethyl 2-[2-(2-methylpropanoylimino)-6-methylsulfanyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-(2-methylpropanoylimino)-6-methylsulfanyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(2-methylpropanoylimino)-6-methylsulfanyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-(2-methyl-1-oxopropyl)imino-6-(methylthio)-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-methylpropanoylimino)-6-methylsulfanyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-isobutyrylimino-6-(methylthio)-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C16H20N2O3S2 MolecularWeight: 352.4716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C(C)C

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C(C)C

InChI

InChI=1S/C16H20N2O3S2/c1-5-21-14(19)9-18-12-7-6-11(22-4)8-13(12)23-16(18)17-15(20)10(2)3/h6-8,10H,5,9H2,1-4H3