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

Systemtic Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-N-(phenylmethyl)-N-propyl-butanamide Openeye Name: N-benzyl-4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxo-N-propyl-butanamide CAS Name: 4-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-4-oxo-N-(phenylmethyl)-N-propylbutanamide IUPAC Name: N-benzyl-4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxo-N-propylbutanamide Traditional Name: N-benzyl-4-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-4-keto-N-propyl-butyramide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C26H35N3O4S/c1-4-14-28(20-23-8-6-5-7-9-23)26(31)13-12-25(30)27-15-17-29(18-16-27)34(32,33)24-19-21(2)10-11-22(24)3/h5-11,19H,4,12-18,20H2,1-3H3