methyl 2-[6-methyl-2-(3-phenoxypropanoylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-methyl-2-(3-phenoxypropanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-methyl-2-(3-phenoxypropanoylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-methyl-2-(1-oxo-3-phenoxypropyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-methyl-2-(3-phenoxypropanoylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-methyl-2-(3-phenoxypropanoylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)CCOC3=CC=CC=C3)S2)CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)CCOC3=CC=CC=C3)S2)CC(=O)OC

InChI

InChI=1S/C20H20N2O4S/c1-14-8-9-16-17(12-14)27-20(22(16)13-19(24)25-2)21-18(23)10-11-26-15-6-4-3-5-7-15/h3-9,12H,10-11,13H2,1-2H3