N,N-diethyl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N,N-diethyl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N,N-diethyl-benzamide CAS Name: N,N-diethyl-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N,N-diethylbenzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N,N-diethyl-benzamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-3-24(4-2)22(26)20-11-8-12-21(17-20)29(27,28)25-15-13-23(14-16-25)18-19-9-6-5-7-10-19/h5-12,17H,3-4,13-16,18H2,1-2H3