1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[4-(4-pyridylmethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[4-(4-pyridylmethyl)phenyl]isonipecotamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NC4=CC=C(C=C4)CC5=CC=NC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NC4=CC=C(C=C4)CC5=CC=NC=C5

InChI

InChI=1S/C27H28N4O2S/c1-2-33-23-7-8-24-25(18-23)34-27(30-24)31-15-11-21(12-16-31)26(32)29-22-5-3-19(4-6-22)17-20-9-13-28-14-10-20/h3-10,13-14,18,21H,2,11-12,15-17H2,1H3,(H,29,32)