1-[3-[3-methyl-2-(pyridin-4-ylsulfanylmethyl)pyridin-4-yl]sulfanylpropyl]-4-(phenylmethyl)piperazine

Systemtic Name: 1-[3-[3-methyl-2-(pyridin-4-ylsulfanylmethyl)pyridin-4-yl]sulfanylpropyl]-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[3-[[3-methyl-2-(4-pyridylsulfanylmethyl)-4-pyridyl]sulfanyl]propyl]piperazine CAS Name: 1-[3-[[3-methyl-2-[(pyridin-4-ylthio)methyl]-4-pyridinyl]thio]propyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-[3-[3-methyl-2-(pyridin-4-ylsulfanylmethyl)pyridin-4-yl]sulfanylpropyl]piperazine Traditional Name: 1-benzyl-4-[3-[[3-methyl-2-[(4-pyridylthio)methyl]-4-pyridyl]thio]propyl]piperazine Formula: C26H32N4S2 MolecularWeight: 464.68908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=CC=NC=C2)SCCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CN=C1CSC2=CC=NC=C2)SCCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H32N4S2/c1-22-25(21-32-24-8-11-27-12-9-24)28-13-10-26(22)31-19-5-14-29-15-17-30(18-16-29)20-23-6-3-2-4-7-23/h2-4,6-13H,5,14-21H2,1H3