4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-butanamide

Systemtic Name: 4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-butanamide Openeye Name: 4-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-(4-methylthiazol-2-yl)-N-phenyl-butanamide CAS Name: 4-(5-bromo-1,3-dioxo-2-isoindolyl)-N-(4-methyl-2-thiazolyl)-N-phenylbutanamide IUPAC Name: 4-(5-bromo-1,3-dioxoisoindol-2-yl)-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylbutanamide Traditional Name: 4-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-(4-methylthiazol-2-yl)-N-phenyl-butyramide Formula: C22H18BrN3O3S MolecularWeight: 484.36562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)N(C2=CC=CC=C2)C(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

CC1=CSC(=N1)N(C2=CC=CC=C2)C(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C22H18BrN3O3S/c1-14-13-30-22(24-14)26(16-6-3-2-4-7-16)19(27)8-5-11-25-20(28)17-10-9-15(23)12-18(17)21(25)29/h2-4,6-7,9-10,12-13H,5,8,11H2,1H3