1-(2,2-diphenylethylsulfonyl)-4-piperazin-1-yl-indole hydrochloride

Systemtic Name: 1-(2,2-diphenylethylsulfonyl)-4-piperazin-1-yl-indole hydrochloride Openeye Name: 1-(2,2-diphenylethylsulfonyl)-4-piperazin-1-yl-indole hydrochloride CAS Name: 1-(2,2-diphenylethylsulfonyl)-4-(1-piperazinyl)indole hydrochloride IUPAC Name: 1-(2,2-diphenylethylsulfonyl)-4-piperazin-1-ylindole hydrochloride Traditional Name: 1-(2,2-diphenylethylsulfonyl)-4-piperazino-indole hydrochloride Formula: C26H28ClN3O2S MolecularWeight: 482.03742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2C=CN3S(=O)(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2C=CN3S(=O)(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5.Cl

InChI

InChI=1S/C26H27N3O2S.ClH/c30-32(31,20-24(21-8-3-1-4-9-21)22-10-5-2-6-11-22)29-17-14-23-25(12-7-13-26(23)29)28-18-15-27-16-19-28;/h1-14,17,24,27H,15-16,18-20H2;1H