N-(2-diethylaminoethyl)-4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: N-(2-diethylaminoethyl)-4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-(2-diethylaminoethyl)-4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxo-butanamide CAS Name: N-(2-diethylaminoethyl)-4-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-(2-diethylaminoethyl)-4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxobutanamide Traditional Name: N-(2-diethylaminoethyl)-4-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-4-keto-butyramide Formula: C22H36N4O4S MolecularWeight: 452.61064

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCN(CC)CCNC(=O)CCC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C22H36N4O4S/c1-5-24(6-2)12-11-23-21(27)9-10-22(28)25-13-15-26(16-14-25)31(29,30)20-17-18(3)7-8-19(20)4/h7-8,17H,5-6,9-16H2,1-4H3,(H,23,27)