4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[2-(4-methylpiperazin-1-yl)phenyl]butanamide

Systemtic Name: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[2-(4-methylpiperazin-1-yl)phenyl]butanamide Openeye Name: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[2-(4-methylpiperazin-1-yl)phenyl]butanamide CAS Name: 4-[(4-fluorophenyl)sulfonyl-methylamino]-N-[2-(4-methyl-1-piperazinyl)phenyl]butanamide IUPAC Name: 4-[(4-fluorophenyl)sulfonyl-methylamino]-N-[2-(4-methylpiperazin-1-yl)phenyl]butanamide Traditional Name: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[2-(4-methylpiperazino)phenyl]butyramide Formula: C22H29FN4O3S MolecularWeight: 448.554063

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H29FN4O3S/c1-25-14-16-27(17-15-25)21-7-4-3-6-20(21)24-22(28)8-5-13-26(2)31(29,30)19-11-9-18(23)10-12-19/h3-4,6-7,9-12H,5,8,13-17H2,1-2H3,(H,24,28)