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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)NC4=CC=C(C=C4)CC5=CC=NC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)NC4=CC=C(C=C4)CC5=CC=NC=C5

InChI

InChI=1S/C27H28N4O2S/c1-2-33-23-9-10-24-25(17-23)34-27(30-24)31-15-3-4-21(18-31)26(32)29-22-7-5-19(6-8-22)16-20-11-13-28-14-12-20/h5-14,17,21H,2-4,15-16,18H2,1H3,(H,29,32)