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

Systemtic Name: 1-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3,3-diphenyl-pyrrolidine-2,5-dione Openeye Name: 1-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3,3-diphenyl-pyrrolidine-2,5-dione CAS Name: 1-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-3,3-diphenylpyrrolidine-2,5-dione IUPAC Name: 1-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3,3-diphenylpyrrolidine-2,5-dione Traditional Name: 1-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butyl]-3,3-diphenyl-pyrrolidine-2,5-quinone Formula: C31H32N4O2S MolecularWeight: 524.67638

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)CC(C2=O)(C3=CC=CC=C3)C4=CC=CC=C4)C5=NSC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)CC(C2=O)(C3=CC=CC=C3)C4=CC=CC=C4)C5=NSC6=CC=CC=C65

InChI

InChI=1S/C31H32N4O2S/c36-28-23-31(24-11-3-1-4-12-24,25-13-5-2-6-14-25)30(37)35(28)18-10-9-17-33-19-21-34(22-20-33)29-26-15-7-8-16-27(26)38-32-29/h1-8,11-16H,9-10,17-23H2