N-[3-(azepan-1-yl)propyl]-1-(6-ethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-1-(6-ethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-1-(6-ethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-1-(6-ethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-1-(6-ethyl-1,3-benzothiazol-2-yl)isonipecotamide Formula: C24H36N4OS MolecularWeight: 428.63384

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NCCCN4CCCCCC4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NCCCN4CCCCCC4

InChI

InChI=1S/C24H36N4OS/c1-2-19-8-9-21-22(18-19)30-24(26-21)28-16-10-20(11-17-28)23(29)25-12-7-15-27-13-5-3-4-6-14-27/h8-9,18,20H,2-7,10-17H2,1H3,(H,25,29)