2-[5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]ethanoate

Systemtic Name: 2-[5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]ethanoate Openeye Name: 2-[5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]acetate CAS Name: 2-[5-[(1Z)-1-(1,3-benzothiazol-2-ylhydrazinylidene)ethyl]-2-methoxyphenyl]acetate IUPAC Name: 2-[5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methylcarbonimidoyl]-2-methoxyphenyl]acetate Traditional Name: 2-[5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]acetate Formula: C18H16N3O3S- MolecularWeight: 354.40294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=CC=CC=C2S1)C3=CC(=C(C=C3)OC)CC(=O)[O-]

Isomeric SMILES

C/C(=N/NC1=NC2=CC=CC=C2S1)/C3=CC(=C(C=C3)OC)CC(=O)[O-]

InChI

InChI=1S/C18H17N3O3S/c1-11(12-7-8-15(24-2)13(9-12)10-17(22)23)20-21-18-19-14-5-3-4-6-16(14)25-18/h3-9H,10H2,1-2H3,(H,19,21)(H,22,23)/p-1/b20-11-