2-(furan-2-ylmethylsulfanyl)-N-[2-[[4-(piperidin-1-ylmethyl)pyridin-2-yl]methylsulfanyl]ethyl]ethanamide

Systemtic Name: 2-(furan-2-ylmethylsulfanyl)-N-[2-[[4-(piperidin-1-ylmethyl)pyridin-2-yl]methylsulfanyl]ethyl]ethanamide Openeye Name: 2-(2-furylmethylsulfanyl)-N-[2-[[4-(1-piperidylmethyl)-2-pyridyl]methylsulfanyl]ethyl]acetamide CAS Name: 2-(2-furanylmethylthio)-N-[2-[[4-(1-piperidinylmethyl)-2-pyridinyl]methylthio]ethyl]acetamide IUPAC Name: 2-(furan-2-ylmethylsulfanyl)-N-[2-[[4-(piperidin-1-ylmethyl)pyridin-2-yl]methylsulfanyl]ethyl]acetamide Traditional Name: 2-(2-furfurylthio)-N-[2-[[4-(piperidinomethyl)-2-pyridyl]methylthio]ethyl]acetamide Formula: C21H29N3O2S2 MolecularWeight: 419.60386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=NC=C2)CSCCNC(=O)CSCC3=CC=CO3

Isomeric SMILES

C1CCN(CC1)CC2=CC(=NC=C2)CSCCNC(=O)CSCC3=CC=CO3

InChI

InChI=1S/C21H29N3O2S2/c25-21(17-28-16-20-5-4-11-26-20)23-8-12-27-15-19-13-18(6-7-22-19)14-24-9-2-1-3-10-24/h4-7,11,13H,1-3,8-10,12,14-17H2,(H,23,25)