N-[2,6-di(propan-2-yl)phenyl]-4-[1-(2-thiophen-2-ylethanoyl)piperidin-4-yl]piperidine-1-carbothioamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-4-[1-(2-thiophen-2-ylethanoyl)piperidin-4-yl]piperidine-1-carbothioamide Openeye Name: N-(2,6-diisopropylphenyl)-4-[1-[2-(2-thienyl)acetyl]-4-piperidyl]piperidine-1-carbothioamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-4-[1-(1-oxo-2-thiophen-2-ylethyl)-4-piperidinyl]-1-piperidinecarbothioamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-4-[1-(2-thiophen-2-ylacetyl)piperidin-4-yl]piperidine-1-carbothioamide Traditional Name: N-(2,6-diisopropylphenyl)-4-[1-[2-(2-thienyl)acetyl]-4-piperidyl]piperidine-1-carbothioamide Formula: C29H41N3OS2 MolecularWeight: 511.78534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=S)N2CCC(CC2)C3CCN(CC3)C(=O)CC4=CC=CS4

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=S)N2CCC(CC2)C3CCN(CC3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C29H41N3OS2/c1-20(2)25-8-5-9-26(21(3)4)28(25)30-29(34)32-16-12-23(13-17-32)22-10-14-31(15-11-22)27(33)19-24-7-6-18-35-24/h5-9,18,20-23H,10-17,19H2,1-4H3,(H,30,34)