methyl 2-[4-chloranyl-2-(3-phenylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[4-chloranyl-2-(3-phenylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[4-chloro-2-(3-phenylpropanoylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[4-chloro-2-(1-oxo-3-phenylpropyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-chloro-2-(3-phenylpropanoylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(4-chloro-2-hydrocinnamoylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C19H17ClN2O3S MolecularWeight: 388.86788

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=CC=C2Cl)SC1=NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CN1C2=C(C=CC=C2Cl)SC1=NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C19H17ClN2O3S/c1-25-17(24)12-22-18-14(20)8-5-9-15(18)26-19(22)21-16(23)11-10-13-6-3-2-4-7-13/h2-9H,10-12H2,1H3