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

Systemtic Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-[(3-methylthiophen-2-yl)methyl]-4-oxidanylidene-butanamide Openeye Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-[(3-methyl-2-thienyl)methyl]-4-oxo-butanamide CAS Name: 4-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-N-[(3-methyl-2-thiophenyl)methyl]-4-oxobutanamide IUPAC Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-[(3-methylthiophen-2-yl)methyl]-4-oxobutanamide Traditional Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-4-keto-N-[(3-methyl-2-thienyl)methyl]butyramide Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)NCC3=C(C=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)NCC3=C(C=CS3)C

InChI

InChI=1S/C22H29N3O4S2/c1-16-4-5-18(3)20(14-16)31(28,29)25-11-9-24(10-12-25)22(27)7-6-21(26)23-15-19-17(2)8-13-30-19/h4-5,8,13-14H,6-7,9-12,15H2,1-3H3,(H,23,26)