4-butoxy-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]benzamide

Systemtic Name: 4-butoxy-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]benzamide Openeye Name: 4-butoxy-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]benzamide CAS Name: 4-butoxy-N-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]benzamide IUPAC Name: 4-butoxy-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]benzamide Traditional Name: 4-butoxy-N-[4-(4-methylpiperazino)sulfonylphenyl]benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C22H29N3O4S/c1-3-4-17-29-20-9-5-18(6-10-20)22(26)23-19-7-11-21(12-8-19)30(27,28)25-15-13-24(2)14-16-25/h5-12H,3-4,13-17H2,1-2H3,(H,23,26)