methyl 2-[4-ethoxy-2-(2-methylphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[4-ethoxy-2-(2-methylphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[4-ethoxy-2-(2-methylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[4-ethoxy-2-[(2-methylphenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-ethoxy-2-(2-methylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(4-ethoxy-2-o-toluoylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=CC=C3C)N2CC(=O)OC

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=CC=C3C)N2CC(=O)OC

InChI

InChI=1S/C20H20N2O4S/c1-4-26-15-10-7-11-16-18(15)22(12-17(23)25-3)20(27-16)21-19(24)14-9-6-5-8-13(14)2/h5-11H,4,12H2,1-3H3