N-[[4-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butoxy]phenyl]methyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-[[4-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butoxy]phenyl]methyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-[[4-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butoxy]phenyl]methyl]-1,3,4-thiadiazol-2-amine CAS Name: N-[[4-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butoxy]phenyl]methyl]-1,3,4-thiadiazol-2-amine IUPAC Name: N-[[4-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butoxy]phenyl]methyl]-1,3,4-thiadiazol-2-amine Traditional Name: [4-[4-[4-(2-methoxyphenyl)piperazino]butoxy]benzyl]-(1,3,4-thiadiazol-2-yl)amine Formula: C24H31N5O2S MolecularWeight: 453.60024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCOC3=CC=C(C=C3)CNC4=NN=CS4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCOC3=CC=C(C=C3)CNC4=NN=CS4

InChI

InChI=1S/C24H31N5O2S/c1-30-23-7-3-2-6-22(23)29-15-13-28(14-16-29)12-4-5-17-31-21-10-8-20(9-11-21)18-25-24-27-26-19-32-24/h2-3,6-11,19H,4-5,12-18H2,1H3,(H,25,27)