ethyl 2-(1,3-benzothiazol-2-ylmethyl)-3-phenyl-propanoate

Systemtic Name: ethyl 2-(1,3-benzothiazol-2-ylmethyl)-3-phenyl-propanoate Openeye Name: ethyl 2-(1,3-benzothiazol-2-ylmethyl)-3-phenyl-propanoate CAS Name: 2-(1,3-benzothiazol-2-ylmethyl)-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzothiazol-2-ylmethyl)-3-phenylpropanoate Traditional Name: 2-(1,3-benzothiazol-2-ylmethyl)-3-phenyl-propionic acid ethyl ester Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19NO2S/c1-2-22-19(21)15(12-14-8-4-3-5-9-14)13-18-20-16-10-6-7-11-17(16)23-18/h3-11,15H,2,12-13H2,1H3