ethyl 2-(6-methylsulfonyl-2-naphthalen-2-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: ethyl 2-(6-methylsulfonyl-2-naphthalen-2-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: ethyl 2-[6-methylsulfonyl-2-(naphthalene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-methylsulfonyl-2-[2-naphthalenyl(oxo)methyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-methylsulfonyl-2-(naphthalene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-mesyl-2-(2-naphthoylimino)-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C23H20N2O5S2 MolecularWeight: 468.5453

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H20N2O5S2/c1-3-30-21(26)14-25-19-11-10-18(32(2,28)29)13-20(19)31-23(25)24-22(27)17-9-8-15-6-4-5-7-16(15)12-17/h4-13H,3,14H2,1-2H3