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

Systemtic Name: methyl 2-[6-acetamido-2-(phenylcarbonylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-(6-acetamido-2-benzoylimino-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(6-acetamido-2-benzoylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester IUPAC Name: methyl 2-(6-acetamido-2-benzoylimino-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(6-acetamido-2-benzoylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC=C3)S2)CC(=O)OC

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC=C3)S2)CC(=O)OC

InChI

InChI=1S/C19H17N3O4S/c1-12(23)20-14-8-9-15-16(10-14)27-19(22(15)11-17(24)26-2)21-18(25)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,20,23)