4-[3-[4-(phenylmethyl)piperazin-1-yl]propylsulfonyl]aniline

Systemtic Name: 4-[3-[4-(phenylmethyl)piperazin-1-yl]propylsulfonyl]aniline Openeye Name: 4-[3-(4-benzylpiperazin-1-yl)propylsulfonyl]aniline CAS Name: 4-[3-[4-(phenylmethyl)-1-piperazinyl]propylsulfonyl]aniline IUPAC Name: 4-[3-(4-benzylpiperazin-1-yl)propylsulfonyl]aniline Traditional Name: [4-[3-(4-benzylpiperazino)propylsulfonyl]phenyl]amine Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCS(=O)(=O)C2=CC=C(C=C2)N)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCCS(=O)(=O)C2=CC=C(C=C2)N)CC3=CC=CC=C3

InChI

InChI=1S/C20H27N3O2S/c21-19-7-9-20(10-8-19)26(24,25)16-4-11-22-12-14-23(15-13-22)17-18-5-2-1-3-6-18/h1-3,5-10H,4,11-17,21H2