4-[3-[4-(1-benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-N,N,5-trimethyl-aniline

Systemtic Name: 4-[3-[4-(1-benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-N,N,5-trimethyl-aniline Openeye Name: 4-[3-[4-(benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-N,N,5-trimethyl-aniline CAS Name: 4-[3-[4-(1-benzothiophen-4-yl)-1-piperazinyl]propoxy]-3-methoxy-N,N,5-trimethylaniline IUPAC Name: 4-[3-[4-(1-benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-N,N,5-trimethylaniline Traditional Name: [4-[3-[4-(benzothiophen-4-yl)piperazino]propoxy]-3-methoxy-5-methyl-phenyl]-dimethyl-amine Formula: C25H33N3O2S MolecularWeight: 439.61342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCN2CCN(CC2)C3=C4C=CSC4=CC=C3)OC)N(C)C

Isomeric SMILES

CC1=CC(=CC(=C1OCCCN2CCN(CC2)C3=C4C=CSC4=CC=C3)OC)N(C)C

InChI

InChI=1S/C25H33N3O2S/c1-19-17-20(26(2)3)18-23(29-4)25(19)30-15-6-10-27-11-13-28(14-12-27)22-7-5-8-24-21(22)9-16-31-24/h5,7-9,16-18H,6,10-15H2,1-4H3