1-(6-chloranyl-1,3-benzothiazol-2-yl)-2-[1-(phenylmethyl)pyrrolidin-3-yl]piperidine-2-carboxamide

Systemtic Name: 1-(6-chloranyl-1,3-benzothiazol-2-yl)-2-[1-(phenylmethyl)pyrrolidin-3-yl]piperidine-2-carboxamide Openeye Name: 2-(1-benzylpyrrolidin-3-yl)-1-(6-chloro-1,3-benzothiazol-2-yl)piperidine-2-carboxamide CAS Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-2-[1-(phenylmethyl)-3-pyrrolidinyl]-2-piperidinecarboxamide IUPAC Name: 2-(1-benzylpyrrolidin-3-yl)-1-(6-chloro-1,3-benzothiazol-2-yl)piperidine-2-carboxamide Traditional Name: 2-(1-benzylpyrrolidin-3-yl)-1-(6-chloro-1,3-benzothiazol-2-yl)pipecolinamide Formula: C24H27ClN4OS MolecularWeight: 455.01538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)(C2CCN(C2)CC3=CC=CC=C3)C(=O)N)C4=NC5=C(S4)C=C(C=C5)Cl

Isomeric SMILES

C1CCN(C(C1)(C2CCN(C2)CC3=CC=CC=C3)C(=O)N)C4=NC5=C(S4)C=C(C=C5)Cl

InChI

InChI=1S/C24H27ClN4OS/c25-19-8-9-20-21(14-19)31-23(27-20)29-12-5-4-11-24(29,22(26)30)18-10-13-28(16-18)15-17-6-2-1-3-7-17/h1-3,6-9,14,18H,4-5,10-13,15-16H2,(H2,26,30)