methyl 3-ethyl-2-(3-phenylpropanoylimino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-ethyl-2-(3-phenylpropanoylimino)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-ethyl-2-(3-phenylpropanoylimino)-1,3-benzothiazole-6-carboxylate CAS Name: 3-ethyl-2-(1-oxo-3-phenylpropyl)imino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-ethyl-2-(3-phenylpropanoylimino)-1,3-benzothiazole-6-carboxylate Traditional Name: 3-ethyl-2-hydrocinnamoylimino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S/c1-3-22-16-11-10-15(19(24)25-2)13-17(16)26-20(22)21-18(23)12-9-14-7-5-4-6-8-14/h4-8,10-11,13H,3,9,12H2,1-2H3