ethyl 3-[2-(2-methylphenyl)carbonylimino-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: ethyl 3-[2-(2-methylphenyl)carbonylimino-1,3-benzothiazol-3-yl]propanoate Openeye Name: ethyl 3-[2-(2-methylbenzoyl)imino-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[(2-methylphenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(2-methylbenzoyl)imino-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-(2-o-toluoylimino-1,3-benzothiazol-3-yl)propionic acid ethyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=CC=CC=C2SC1=NC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)CCN1C2=CC=CC=C2SC1=NC(=O)C3=CC=CC=C3C

InChI

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