4-[4-(phenylmethyl)piperazin-1-yl]-1-(4-propylphenyl)sulfonyl-indole hydrochloride

Systemtic Name: 4-[4-(phenylmethyl)piperazin-1-yl]-1-(4-propylphenyl)sulfonyl-indole hydrochloride Openeye Name: 4-(4-benzylpiperazin-1-yl)-1-(4-propylphenyl)sulfonyl-indole hydrochloride CAS Name: 4-[4-(phenylmethyl)-1-piperazinyl]-1-(4-propylphenyl)sulfonylindole hydrochloride IUPAC Name: 4-(4-benzylpiperazin-1-yl)-1-(4-propylphenyl)sulfonylindole hydrochloride Traditional Name: 4-(4-benzylpiperazino)-1-(4-propylphenyl)sulfonyl-indole hydrochloride Formula: C28H32ClN3O2S MolecularWeight: 510.09058

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC=C3N4CCN(CC4)CC5=CC=CC=C5.Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC=C3N4CCN(CC4)CC5=CC=CC=C5.Cl

InChI

InChI=1S/C28H31N3O2S.ClH/c1-2-7-23-12-14-25(15-13-23)34(32,33)31-17-16-26-27(10-6-11-28(26)31)30-20-18-29(19-21-30)22-24-8-4-3-5-9-24;/h3-6,8-17H,2,7,18-22H2,1H3;1H