N-[2-[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]pyrazol-3-yl]oxolane-3-carboxamide

Systemtic Name: N-[2-[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]pyrazol-3-yl]oxolane-3-carboxamide Openeye Name: N-[2-[1-(2-phenylsulfanylacetyl)-4-piperidyl]pyrazol-3-yl]tetrahydrofuran-3-carboxamide CAS Name: N-[2-[1-[1-oxo-2-(phenylthio)ethyl]-4-piperidinyl]-3-pyrazolyl]-3-oxolanecarboxamide IUPAC Name: N-[2-[1-(2-phenylsulfanylacetyl)piperidin-4-yl]pyrazol-3-yl]oxolane-3-carboxamide Traditional Name: N-[2-[1-[2-(phenylthio)acetyl]-4-piperidyl]pyrazol-3-yl]tetrahydrofuran-3-carboxamide Formula: C21H26N4O3S MolecularWeight: 414.52114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=CC=N2)NC(=O)C3CCOC3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1N2C(=CC=N2)NC(=O)C3CCOC3)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C21H26N4O3S/c26-20(15-29-18-4-2-1-3-5-18)24-11-7-17(8-12-24)25-19(6-10-22-25)23-21(27)16-9-13-28-14-16/h1-6,10,16-17H,7-9,11-15H2,(H,23,27)