4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-ethylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-ethylphenyl)-4-oxidanylidene-butanamide Openeye Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-ethylphenyl)-4-oxo-butanamide CAS Name: 4-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(3-ethylphenyl)-4-oxobutanamide IUPAC Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-ethylphenyl)-4-oxobutanamide Traditional Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-N-(3-ethylphenyl)-4-keto-butyramide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C24H31N3O4S/c1-4-20-6-5-7-21(17-20)25-23(28)10-11-24(29)26-12-14-27(15-13-26)32(30,31)22-16-18(2)8-9-19(22)3/h5-9,16-17H,4,10-15H2,1-3H3,(H,25,28)