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

Systemtic Name: 1-(4-butoxyphenyl)sulfonyl-5-[4-(phenylmethyl)piperazin-1-yl]indole Openeye Name: 5-(4-benzylpiperazin-1-yl)-1-(4-butoxyphenyl)sulfonyl-indole CAS Name: 1-(4-butoxyphenyl)sulfonyl-5-[4-(phenylmethyl)-1-piperazinyl]indole IUPAC Name: 5-(4-benzylpiperazin-1-yl)-1-(4-butoxyphenyl)sulfonylindole Traditional Name: 5-(4-benzylpiperazino)-1-(4-butoxyphenyl)sulfonyl-indole Formula: C29H33N3O3S MolecularWeight: 503.65562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC(=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC(=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H33N3O3S/c1-2-3-21-35-27-10-12-28(13-11-27)36(33,34)32-16-15-25-22-26(9-14-29(25)32)31-19-17-30(18-20-31)23-24-7-5-4-6-8-24/h4-16,22H,2-3,17-21,23H2,1H3