N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-phenoxy-butanamide

Systemtic Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-phenoxy-butanamide Openeye Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-phenoxy-butanamide CAS Name: N-[3-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-2-phenoxybutanamide IUPAC Name: N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-phenoxybutanamide Traditional Name: N-[3-(4-ethylpiperazino)sulfonylphenyl]-2-phenoxy-butyramide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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