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

Systemtic Name: ethyl 2-[4-methyl-2-(3-methylphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[4-methyl-2-(3-methylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[4-methyl-2-[(3-methylphenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-methyl-2-(3-methylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(4-methyl-2-m-toluoylimino-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=CC=C2SC1=NC(=O)C3=CC(=CC=C3)C)C

Isomeric SMILES

CCOC(=O)CN1C2=C(C=CC=C2SC1=NC(=O)C3=CC(=CC=C3)C)C

InChI

InChI=1S/C20H20N2O3S/c1-4-25-17(23)12-22-18-14(3)8-6-10-16(18)26-20(22)21-19(24)15-9-5-7-13(2)11-15/h5-11H,4,12H2,1-3H3