N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)carbonyl-N-ethyl-piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)carbonyl-N-ethyl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-(4-chlorobenzoyl)-N-ethyl-piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-[(4-chlorophenyl)-oxomethyl]-N-ethyl-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-(4-chlorobenzoyl)-N-ethylpiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-(4-chlorobenzoyl)-N-ethyl-nipecotamide Formula: C22H22ClN3O2S MolecularWeight: 427.94698

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O2S/c1-2-26(22-24-18-7-3-4-8-19(18)29-22)21(28)16-6-5-13-25(14-16)20(27)15-9-11-17(23)12-10-15/h3-4,7-12,16H,2,5-6,13-14H2,1H3