methyl 2-[6-methoxy-2-(2-naphthalen-2-ylethanoylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-methoxy-2-(2-naphthalen-2-ylethanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-methoxy-2-[2-(2-naphthyl)acetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-methoxy-2-[2-(2-naphthalenyl)-1-oxoethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-methoxy-2-(2-naphthalen-2-ylacetyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-methoxy-2-[2-(2-naphthyl)acetyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=NC(=O)CC3=CC4=CC=CC=C4C=C3)S2)CC(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=NC(=O)CC3=CC4=CC=CC=C4C=C3)S2)CC(=O)OC

InChI

InChI=1S/C23H20N2O4S/c1-28-18-9-10-19-20(13-18)30-23(25(19)14-22(27)29-2)24-21(26)12-15-7-8-16-5-3-4-6-17(16)11-15/h3-11,13H,12,14H2,1-2H3