1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidine-2,5-dione

Systemtic Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidine-2,5-dione Openeye Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-[4-(2-pyridyl)piperazin-1-yl]pyrrolidine-2,5-dione CAS Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-[4-(2-pyridinyl)-1-piperazinyl]pyrrolidine-2,5-dione IUPAC Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidine-2,5-dione Traditional Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-[4-(2-pyridyl)piperazino]pyrrolidine-2,5-quinone Formula: C27H25N5O2S MolecularWeight: 483.5847

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N4C(=O)CC(C4=O)N5CCN(CC5)C6=CC=CC=N6

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N4C(=O)CC(C4=O)N5CCN(CC5)C6=CC=CC=N6

InChI

InChI=1S/C27H25N5O2S/c1-18-5-10-21-23(16-18)35-26(29-21)19-6-8-20(9-7-19)32-25(33)17-22(27(32)34)30-12-14-31(15-13-30)24-4-2-3-11-28-24/h2-11,16,22H,12-15,17H2,1H3