methyl 2-[6-fluoranyl-2-(2-methylphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-fluoranyl-2-(2-methylphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-fluoro-2-(2-methylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-fluoro-2-[(2-methylphenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-fluoro-2-(2-methylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(6-fluoro-2-o-toluoylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C18H15FN2O3S MolecularWeight: 358.386703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N=C2N(C3=C(S2)C=C(C=C3)F)CC(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)N=C2N(C3=C(S2)C=C(C=C3)F)CC(=O)OC

InChI

InChI=1S/C18H15FN2O3S/c1-11-5-3-4-6-13(11)17(23)20-18-21(10-16(22)24-2)14-8-7-12(19)9-15(14)25-18/h3-9H,10H2,1-2H3