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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29FN4O3S/c1-25-14-16-27(17-15-25)20-9-7-19(8-10-20)24-22(28)4-3-13-26(2)31(29,30)21-11-5-18(23)6-12-21/h5-12H,3-4,13-17H2,1-2H3,(H,24,28)