1-[4-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]sulfonylphenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]sulfonylphenyl]pyrrolidin-2-one Openeye Name: 1-[4-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]sulfonylphenyl]pyrrolidin-2-one CAS Name: 1-[4-[[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]sulfonyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]sulfonylphenyl]pyrrolidin-2-one Traditional Name: 1-[4-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]sulfonylphenyl]-2-pyrrolidone Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H24N4O3S2/c27-22-6-3-11-26(22)17-7-9-18(10-8-17)31(28,29)25-14-12-24(13-15-25)16-21-23-19-4-1-2-5-20(19)30-21/h1-2,4-5,7-10H,3,6,11-16H2