1-(6-chloranyl-1,3-benzothiazol-2-yl)-N-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(6-chloranyl-1,3-benzothiazol-2-yl)-N-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-N-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-N-[(2-methoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-N-[(2-methoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-N-o-anisyl-isonipecotamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-27-18-5-3-2-4-15(18)13-23-20(26)14-8-10-25(11-9-14)21-24-17-7-6-16(22)12-19(17)28-21/h2-7,12,14H,8-11,13H2,1H3,(H,23,26)