2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenyl-propanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenyl-propanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenyl-propanamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenylpropanamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenylpropanamide Traditional Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenyl-2-phthalimido-propionamide Formula: C25H19N3O3S MolecularWeight: 441.50166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H19N3O3S/c1-15-8-7-13-20-21(15)26-25(32-20)27-22(29)19(14-16-9-3-2-4-10-16)28-23(30)17-11-5-6-12-18(17)24(28)31/h2-13,19H,14H2,1H3,(H,26,27,29)