2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-(isopentylamino)thiazole-4-carboxylate CAS Name: 2-(3-methylbutylamino)-4-thiazolecarboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-(3-methylbutylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(isoamylamino)thiazole-4-carboxylic acid 2-phthalimidoethyl ester Formula: C19H21N3O4S MolecularWeight: 387.45274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=CS1)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)CCNC1=NC(=CS1)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H21N3O4S/c1-12(2)7-8-20-19-21-15(11-27-19)18(25)26-10-9-22-16(23)13-5-3-4-6-14(13)17(22)24/h3-6,11-12H,7-10H2,1-2H3,(H,20,21)