3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(2,4-dimethylphenyl)pyrrolidine-2,5-dione

Systemtic Name: 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(2,4-dimethylphenyl)pyrrolidine-2,5-dione Openeye Name: 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(2,4-dimethylphenyl)pyrrolidine-2,5-dione CAS Name: 3-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-1-(2,4-dimethylphenyl)pyrrolidine-2,5-dione IUPAC Name: 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(2,4-dimethylphenyl)pyrrolidine-2,5-dione Traditional Name: 3-[4-(1,3-benzothiazol-2-yl)piperazino]-1-(2,4-dimethylphenyl)pyrrolidine-2,5-quinone Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C23H24N4O2S/c1-15-7-8-18(16(2)13-15)27-21(28)14-19(22(27)29)25-9-11-26(12-10-25)23-24-17-5-3-4-6-20(17)30-23/h3-8,13,19H,9-12,14H2,1-2H3