2-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-oxidanylidene-butyl]-5-methyl-isoindole-1,3-dione

Systemtic Name: 2-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-oxidanylidene-butyl]-5-methyl-isoindole-1,3-dione Openeye Name: 2-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-oxo-butyl]-5-methyl-isoindoline-1,3-dione CAS Name: 2-[4-[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-4-oxobutyl]-5-methylisoindole-1,3-dione IUPAC Name: 2-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-oxobutyl]-5-methylisoindole-1,3-dione Traditional Name: 2-[4-[2-(1,3-benzothiazol-2-yl)pyrrolidino]-4-keto-butyl]-5-methyl-isoindoline-1,3-quinone Formula: C24H23N3O3S MolecularWeight: 433.52272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)N3CCCC3C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)N3CCCC3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H23N3O3S/c1-15-10-11-16-17(14-15)24(30)27(23(16)29)13-5-9-21(28)26-12-4-7-19(26)22-25-18-6-2-3-8-20(18)31-22/h2-3,6,8,10-11,14,19H,4-5,7,9,12-13H2,1H3