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

Systemtic Name: 2-[1-[2-(1,3-thiazolidin-3-ylcarbonyl)-3H-pyrrolizin-4-ium-4-yl]piperidin-4-yl]-1,3-benzothiazole-5-carbonitrile Openeye Name: 2-[1-[2-(thiazolidine-3-carbonyl)-3H-pyrrolizin-4-ium-4-yl]-4-piperidyl]-1,3-benzothiazole-5-carbonitrile CAS Name: 2-[1-[2-[oxo(3-thiazolidinyl)methyl]-3H-pyrrolizin-4-ium-4-yl]-4-piperidinyl]-1,3-benzothiazole-5-carbonitrile IUPAC Name: 2-[1-[2-(1,3-thiazolidine-3-carbonyl)-3H-pyrrolizin-4-ium-4-yl]piperidin-4-yl]-1,3-benzothiazole-5-carbonitrile Traditional Name: 2-[1-[2-(thiazolidine-3-carbonyl)-3H-pyrrolizin-4-ium-4-yl]-4-piperidyl]-1,3-benzothiazole-5-carbonitrile Formula: C24H24N5OS2+ MolecularWeight: 462.61026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=C(S2)C=CC(=C3)C#N)[N+]45CC(=CC4=CC=C5)C(=O)N6CCSC6

Isomeric SMILES

C1CN(CCC1C2=NC3=C(S2)C=CC(=C3)C#N)[N+]45CC(=CC4=CC=C5)C(=O)N6CCSC6

InChI

InChI=1S/C24H24N5OS2/c25-14-17-3-4-22-21(12-17)26-23(32-22)18-5-7-28(8-6-18)29-10-1-2-20(29)13-19(15-29)24(30)27-9-11-31-16-27/h1-4,10,12-13,18H,5-9,11,15-16H2/q+1