2-(3-methylphenoxy)-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]butanamide

Systemtic Name: 2-(3-methylphenoxy)-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]butanamide Openeye Name: 2-(3-methylphenoxy)-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]butanamide CAS Name: 2-(3-methylphenoxy)-N-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]butanamide IUPAC Name: 2-(3-methylphenoxy)-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]butanamide Traditional Name: 2-(3-methylphenoxy)-N-[4-(4-methylpiperazino)sulfonylphenyl]butyramide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C)OC3=CC=CC(=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C)OC3=CC=CC(=C3)C

InChI

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