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

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: N-[2-(1-azepanyl)ethyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)isonipecotamide Formula: C23H34N4O2S MolecularWeight: 430.60666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NCCN4CCCCCC4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NCCN4CCCCCC4

InChI

InChI=1S/C23H34N4O2S/c1-2-29-19-7-8-20-21(17-19)30-23(25-20)27-14-9-18(10-15-27)22(28)24-11-16-26-12-5-3-4-6-13-26/h7-8,17-18H,2-6,9-16H2,1H3,(H,24,28)