1-phenyl-2-[1-[2-(1,3-thiazolidin-3-ylcarbonyl)-3H-pyrrolizin-4-ium-4-yl]piperidin-4-yl]benzimidazole-5-carbonitrile

Systemtic Name: 1-phenyl-2-[1-[2-(1,3-thiazolidin-3-ylcarbonyl)-3H-pyrrolizin-4-ium-4-yl]piperidin-4-yl]benzimidazole-5-carbonitrile Openeye Name: 1-phenyl-2-[1-[2-(thiazolidine-3-carbonyl)-3H-pyrrolizin-4-ium-4-yl]-4-piperidyl]benzimidazole-5-carbonitrile CAS Name: 2-[1-[2-[oxo(3-thiazolidinyl)methyl]-3H-pyrrolizin-4-ium-4-yl]-4-piperidinyl]-1-phenyl-5-benzimidazolecarbonitrile IUPAC Name: 1-phenyl-2-[1-[2-(1,3-thiazolidine-3-carbonyl)-3H-pyrrolizin-4-ium-4-yl]piperidin-4-yl]benzimidazole-5-carbonitrile Traditional Name: 1-phenyl-2-[1-[2-(thiazolidine-3-carbonyl)-3H-pyrrolizin-4-ium-4-yl]-4-piperidyl]benzimidazole-5-carbonitrile Formula: C30H29N6OS+ MolecularWeight: 521.65586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=C(N2C4=CC=CC=C4)C=CC(=C3)C#N)[N+]56CC(=CC5=CC=C6)C(=O)N7CCSC7

Isomeric SMILES

C1CN(CCC1C2=NC3=C(N2C4=CC=CC=C4)C=CC(=C3)C#N)[N+]56CC(=CC5=CC=C6)C(=O)N7CCSC7

InChI

InChI=1S/C30H29N6OS/c31-19-22-8-9-28-27(17-22)32-29(35(28)25-5-2-1-3-6-25)23-10-12-34(13-11-23)36-15-4-7-26(36)18-24(20-36)30(37)33-14-16-38-21-33/h1-9,15,17-18,23H,10-14,16,20-21H2/q+1