2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)pentanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)pentanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-4-methyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)pentanamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-methyl-N-[6-(1-pyrrolidinylsulfonyl)-1,3-benzothiazol-2-yl]pentanamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-4-methyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)pentanamide Traditional Name: 4-methyl-2-phthalimido-N-(6-pyrrolidinosulfonyl-1,3-benzothiazol-2-yl)valeramide Formula: C25H26N4O5S2 MolecularWeight: 526.62774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCCC3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC(C)CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCCC3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H26N4O5S2/c1-15(2)13-20(29-23(31)17-7-3-4-8-18(17)24(29)32)22(30)27-25-26-19-10-9-16(14-21(19)35-25)36(33,34)28-11-5-6-12-28/h3-4,7-10,14-15,20H,5-6,11-13H2,1-2H3,(H,26,27,30)