1-(1-benzothiophen-3-yl)-2-butyl-3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]heptan-1-ol

Systemtic Name: 1-(1-benzothiophen-3-yl)-2-butyl-3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]heptan-1-ol Openeye Name: 1-(benzothiophen-3-yl)-2-butyl-3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]heptan-1-ol CAS Name: 1-(1-benzothiophen-3-yl)-2-butyl-3-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-1-heptanol IUPAC Name: 1-(1-benzothiophen-3-yl)-2-butyl-3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]heptan-1-ol Traditional Name: 1-(benzothiophen-3-yl)-2-butyl-3-[4-(4-chlorobenzyl)piperazino]heptan-1-ol Formula: C30H41ClN2OS MolecularWeight: 513.17734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CCCC)N1CCN(CC1)CC2=CC=C(C=C2)Cl)C(C3=CSC4=CC=CC=C43)O

Isomeric SMILES

CCCCC(C(CCCC)N1CCN(CC1)CC2=CC=C(C=C2)Cl)C(C3=CSC4=CC=CC=C43)O

InChI

InChI=1S/C30H41ClN2OS/c1-3-5-9-26(30(34)27-22-35-29-12-8-7-10-25(27)29)28(11-6-4-2)33-19-17-32(18-20-33)21-23-13-15-24(31)16-14-23/h7-8,10,12-16,22,26,28,30,34H,3-6,9,11,17-21H2,1-2H3