methyl 2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylimino]-4,6-bis(fluoranyl)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylimino]-4,6-bis(fluoranyl)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(3-chlorobenzothiophene-2-carbonyl)imino-4,6-difluoro-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]imino-4,6-difluoro-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3-chloro-1-benzothiophene-2-carbonyl)imino-4,6-difluoro-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(3-chlorobenzothiophene-2-carbonyl)imino-4,6-difluoro-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C19H11ClF2N2O3S2 MolecularWeight: 452.882046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(C=C2SC1=NC(=O)C3=C(C4=CC=CC=C4S3)Cl)F)F

Isomeric SMILES

COC(=O)CN1C2=C(C=C(C=C2SC1=NC(=O)C3=C(C4=CC=CC=C4S3)Cl)F)F

InChI

InChI=1S/C19H11ClF2N2O3S2/c1-27-14(25)8-24-16-11(22)6-9(21)7-13(16)29-19(24)23-18(26)17-15(20)10-4-2-3-5-12(10)28-17/h2-7H,8H2,1H3