2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(cyclopentylcarbamoyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(cyclopentylcarbamoyl)ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(cyclopentylcarbamoyl)acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-yl)-1-piperidin-1-iumyl]-N-[(cyclopentylamino)-oxomethyl]acetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(cyclopentylcarbamoyl)acetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(cyclopentylcarbamoyl)acetamide Formula: C20H27N4O2S+ MolecularWeight: 387.51898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)NC(=O)C[NH+]2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCC(C1)NC(=O)NC(=O)C[NH+]2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H26N4O2S/c25-18(23-20(26)21-15-5-1-2-6-15)13-24-11-9-14(10-12-24)19-22-16-7-3-4-8-17(16)27-19/h3-4,7-8,14-15H,1-2,5-6,9-13H2,(H2,21,23,25,26)/p+1