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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindolin-2-yl)-3-methyl-butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxo-2-isoindolyl)-3-methylbutanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-methylbutanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-methyl-2-phthalimido-butyramide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NC2=CC=CC=C2S1)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)C(C(=O)NC1=NC2=CC=CC=C2S1)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H17N3O3S/c1-11(2)16(23-18(25)12-7-3-4-8-13(12)19(23)26)17(24)22-20-21-14-9-5-6-10-15(14)27-20/h3-11,16H,1-2H3,(H,21,22,24)