1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-[methyl-(phenylmethyl)amino]propyl]piperidine-3-carboxamide

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-[methyl-(phenylmethyl)amino]propyl]piperidine-3-carboxamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-3-piperidinecarboxamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)nipecotamide Formula: C26H34N4O2S MolecularWeight: 466.63876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)NCCCN(C)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)NCCCN(C)CC4=CC=CC=C4

InChI

InChI=1S/C26H34N4O2S/c1-3-32-22-12-13-23-24(17-22)33-26(28-23)30-16-7-11-21(19-30)25(31)27-14-8-15-29(2)18-20-9-5-4-6-10-20/h4-6,9-10,12-13,17,21H,3,7-8,11,14-16,18-19H2,1-2H3,(H,27,31)