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

Systemtic Name: N-[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-oxo-4-[4-(p-tolylsulfonyl)piperazin-1-yl]butyl]thiophene-2-carboxamide CAS Name: N-[4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-keto-4-(4-tosylpiperazino)butyl]thiophene-2-carboxamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S2/c1-16-6-8-17(9-7-16)29(26,27)23-13-11-22(12-14-23)19(24)5-2-10-21-20(25)18-4-3-15-28-18/h3-4,6-9,15H,2,5,10-14H2,1H3,(H,21,25)