methyl 2-[2-(3-fluorophenyl)carbonylimino-4,6-dimethyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(3-fluorophenyl)carbonylimino-4,6-dimethyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(3-fluorobenzoyl)imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(3-fluorophenyl)-oxomethyl]imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3-fluorobenzoyl)imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(3-fluorobenzoyl)imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C19H17FN2O3S MolecularWeight: 372.413283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=NC(=O)C3=CC(=CC=C3)F)N2CC(=O)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=NC(=O)C3=CC(=CC=C3)F)N2CC(=O)OC)C

InChI

InChI=1S/C19H17FN2O3S/c1-11-7-12(2)17-15(8-11)26-19(22(17)10-16(23)25-3)21-18(24)13-5-4-6-14(20)9-13/h4-9H,10H2,1-3H3