N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide

Systemtic Name: N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide Openeye Name: N-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-3-(1-methylene-3-oxo-isoindolin-2-yl)propanamide CAS Name: N-[4-(4-bromophenyl)-5-methyl-2-thiazolyl]-3-(1-methylene-3-oxo-2-isoindolyl)propanamide IUPAC Name: N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-3-(1-methylidene-3-oxoisoindol-2-yl)propanamide Traditional Name: N-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-3-(1-keto-3-methylene-isoindolin-2-yl)propionamide Formula: C22H18BrN3O2S MolecularWeight: 468.36622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)CCN2C(=C)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)CCN2C(=C)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H18BrN3O2S/c1-13-17-5-3-4-6-18(17)21(28)26(13)12-11-19(27)24-22-25-20(14(2)29-22)15-7-9-16(23)10-8-15/h3-10H,1,11-12H2,2H3,(H,24,25,27)