N-butan-2-yl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-butan-2-yl-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-butan-2-ylbenzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-sec-butyl-benzamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O3S/c1-3-18(2)23-22(26)20-10-7-11-21(16-20)29(27,28)25-14-12-24(13-15-25)17-19-8-5-4-6-9-19/h4-11,16,18H,3,12-15,17H2,1-2H3,(H,23,26)