5-[4-(phenylmethyl)piperazin-1-yl]-1-(4-propylphenyl)sulfonyl-indole

Systemtic Name: 5-[4-(phenylmethyl)piperazin-1-yl]-1-(4-propylphenyl)sulfonyl-indole Openeye Name: 5-(4-benzylpiperazin-1-yl)-1-(4-propylphenyl)sulfonyl-indole CAS Name: 5-[4-(phenylmethyl)-1-piperazinyl]-1-(4-propylphenyl)sulfonylindole IUPAC Name: 5-(4-benzylpiperazin-1-yl)-1-(4-propylphenyl)sulfonylindole Traditional Name: 5-(4-benzylpiperazino)-1-(4-propylphenyl)sulfonyl-indole Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC(=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC(=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

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