2-phenyl-N-[2-[1-(thian-4-yl)piperidin-4-yl]pyrazol-3-yl]ethanamide

Systemtic Name: 2-phenyl-N-[2-[1-(thian-4-yl)piperidin-4-yl]pyrazol-3-yl]ethanamide Openeye Name: 2-phenyl-N-[2-(1-tetrahydrothiopyran-4-yl-4-piperidyl)pyrazol-3-yl]acetamide CAS Name: 2-phenyl-N-[2-[1-(4-thianyl)-4-piperidinyl]-3-pyrazolyl]acetamide IUPAC Name: 2-phenyl-N-[2-[1-(thian-4-yl)piperidin-4-yl]pyrazol-3-yl]acetamide Traditional Name: 2-phenyl-N-[2-(1-tetrahydrothiopyran-4-yl-4-piperidyl)pyrazol-3-yl]acetamide Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=CC=N2)NC(=O)CC3=CC=CC=C3)C4CCSCC4

Isomeric SMILES

C1CN(CCC1N2C(=CC=N2)NC(=O)CC3=CC=CC=C3)C4CCSCC4

InChI

InChI=1S/C21H28N4OS/c26-21(16-17-4-2-1-3-5-17)23-20-6-11-22-25(20)19-7-12-24(13-8-19)18-9-14-27-15-10-18/h1-6,11,18-19H,7-10,12-16H2,(H,23,26)