N-[4-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-4-keto-butyl]thiophene-2-carboxamide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCNC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCNC(=O)C3=CC=CS3)C

InChI

InChI=1S/C21H27N3O4S2/c1-16-7-8-19(17(2)15-16)30(27,28)24-12-10-23(11-13-24)20(25)6-3-9-22-21(26)18-5-4-14-29-18/h4-5,7-8,14-15H,3,6,9-13H2,1-2H3,(H,22,26)