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

Systemtic Name: methyl 2-[6-acetamido-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N=C1N(C2=C(S1)C=C(C=C2)NC(=O)C)CC(=O)OC

Isomeric SMILES

CC(C)C(=O)N=C1N(C2=C(S1)C=C(C=C2)NC(=O)C)CC(=O)OC

InChI

InChI=1S/C16H19N3O4S/c1-9(2)15(22)18-16-19(8-14(21)23-4)12-6-5-11(17-10(3)20)7-13(12)24-16/h5-7,9H,8H2,1-4H3,(H,17,20)