5-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-2-prop-2-enyl-isoindole-1,3-dione

Systemtic Name: 5-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-2-prop-2-enyl-isoindole-1,3-dione Openeye Name: 2-allyl-5-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]isoindoline-1,3-dione CAS Name: 5-[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-2-prop-2-enylisoindole-1,3-dione IUPAC Name: 5-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-prop-2-enylisoindole-1,3-dione Traditional Name: 2-allyl-5-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]isoindoline-1,3-quinone Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCCC3C4=NC5=CC=CC=C5S4

Isomeric SMILES

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCCC3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H19N3O3S/c1-2-11-26-22(28)15-10-9-14(13-16(15)23(26)29)21(27)25-12-5-7-18(25)20-24-17-6-3-4-8-19(17)30-20/h2-4,6,8-10,13,18H,1,5,7,11-12H2