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

Systemtic Name: ethyl 2-[6-acetamido-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-acetamido-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-acetamido-2-(2-methyl-1-oxopropyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-acetamido-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(6-acetamido-2-isobutyrylimino-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O4S/c1-5-24-15(22)9-20-13-7-6-12(18-11(4)21)8-14(13)25-17(20)19-16(23)10(2)3/h6-8,10H,5,9H2,1-4H3,(H,18,21)