ethyl 2-[1-[(4-bromanyl-1,3-benzothiazol-2-yl)methyl]-2-oxidanylidene-3,4-dihydroquinolin-3-yl]ethanoate

Systemtic Name: ethyl 2-[1-[(4-bromanyl-1,3-benzothiazol-2-yl)methyl]-2-oxidanylidene-3,4-dihydroquinolin-3-yl]ethanoate Openeye Name: ethyl 2-[1-[(4-bromo-1,3-benzothiazol-2-yl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]acetate CAS Name: 2-[1-[(4-bromo-1,3-benzothiazol-2-yl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[(4-bromo-1,3-benzothiazol-2-yl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]acetate Traditional Name: 2-[1-[(4-bromo-1,3-benzothiazol-2-yl)methyl]-2-keto-3,4-dihydroquinolin-3-yl]acetic acid ethyl ester Formula: C21H19BrN2O3S MolecularWeight: 459.35616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CC2=CC=CC=C2N(C1=O)CC3=NC4=C(S3)C=CC=C4Br

Isomeric SMILES

CCOC(=O)CC1CC2=CC=CC=C2N(C1=O)CC3=NC4=C(S3)C=CC=C4Br

InChI

InChI=1S/C21H19BrN2O3S/c1-2-27-19(25)11-14-10-13-6-3-4-8-16(13)24(21(14)26)12-18-23-20-15(22)7-5-9-17(20)28-18/h3-9,14H,2,10-12H2,1H3