N5-[4-[3-(piperidin-1-ylmethyl)phenoxy]butyl]-N2-pyridin-2-ylsulfanyl-1,3,4-thiadiazole-2,5-diamine

Systemtic Name: N5-[4-[3-(piperidin-1-ylmethyl)phenoxy]butyl]-N2-pyridin-2-ylsulfanyl-1,3,4-thiadiazole-2,5-diamine Openeye Name: N5-[4-[3-(1-piperidylmethyl)phenoxy]butyl]-N2-(2-pyridylsulfanyl)-1,3,4-thiadiazole-2,5-diamine CAS Name: N-[5-[4-[3-(1-piperidinylmethyl)phenoxy]butylamino]-1,3,4-thiadiazol-2-yl]-2-pyridinesulfenamide IUPAC Name: 5-N-[4-[3-(piperidin-1-ylmethyl)phenoxy]butyl]-2-N-pyridin-2-ylsulfanyl-1,3,4-thiadiazole-2,5-diamine Traditional Name: 4-[3-(piperidinomethyl)phenoxy]butyl-[5-[(2-pyridylthio)amino]-1,3,4-thiadiazol-2-yl]amine Formula: C23H30N6OS2 MolecularWeight: 470.6539

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCCNC3=NN=C(S3)NSC4=CC=CC=N4

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCCNC3=NN=C(S3)NSC4=CC=CC=N4

InChI

InChI=1S/C23H30N6OS2/c1-5-14-29(15-6-1)18-19-9-8-10-20(17-19)30-16-7-4-13-25-22-26-27-23(31-22)28-32-21-11-2-3-12-24-21/h2-3,8-12,17H,1,4-7,13-16,18H2,(H,25,26)(H,27,28)