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

Systemtic Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide Openeye Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-3-(1-methylene-3-oxo-isoindolin-2-yl)propanamide CAS Name: N-[4-(4-methoxyphenyl)-2-thiazolyl]-3-(1-methylene-3-oxo-2-isoindolyl)propanamide IUPAC Name: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(1-methylidene-3-oxoisoindol-2-yl)propanamide Traditional Name: 3-(1-keto-3-methylene-isoindolin-2-yl)-N-[4-(4-methoxyphenyl)thiazol-2-yl]propionamide Formula: C22H19N3O3S MolecularWeight: 405.46956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCN3C(=C)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCN3C(=C)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H19N3O3S/c1-14-17-5-3-4-6-18(17)21(27)25(14)12-11-20(26)24-22-23-19(13-29-22)15-7-9-16(28-2)10-8-15/h3-10,13H,1,11-12H2,2H3,(H,23,24,26)