N-[[4-(3-aminophenyl)-1-(phenylmethyl)piperazin-2-yl]methyl]-4-(methylsulfonylamino)benzamide

Systemtic Name: N-[[4-(3-aminophenyl)-1-(phenylmethyl)piperazin-2-yl]methyl]-4-(methylsulfonylamino)benzamide Openeye Name: N-[[4-(3-aminophenyl)-1-benzyl-piperazin-2-yl]methyl]-4-(methanesulfonamido)benzamide CAS Name: N-[[4-(3-aminophenyl)-1-(phenylmethyl)-2-piperazinyl]methyl]-4-(methanesulfonamido)benzamide IUPAC Name: N-[[4-(3-aminophenyl)-1-benzylpiperazin-2-yl]methyl]-4-(methanesulfonamido)benzamide Traditional Name: N-[[4-(3-aminophenyl)-1-benzyl-piperazin-2-yl]methyl]-4-(methanesulfonamido)benzamide Formula: C26H31N5O3S MolecularWeight: 493.62104

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)NCC2CN(CCN2CC3=CC=CC=C3)C4=CC(=CC=C4)N

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)NCC2CN(CCN2CC3=CC=CC=C3)C4=CC(=CC=C4)N

InChI

InChI=1S/C26H31N5O3S/c1-35(33,34)29-23-12-10-21(11-13-23)26(32)28-17-25-19-31(24-9-5-8-22(27)16-24)15-14-30(25)18-20-6-3-2-4-7-20/h2-13,16,25,29H,14-15,17-19,27H2,1H3,(H,28,32)