N-[4-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-keto-4-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]butyl]thiophene-2-carboxamide Formula: C18H23N3O4S3 MolecularWeight: 441.58792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)CCCNC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)CCCNC(=O)C3=CC=CS3

InChI

InChI=1S/C18H23N3O4S3/c1-14-6-7-17(27-14)28(24,25)21-11-9-20(10-12-21)16(22)5-2-8-19-18(23)15-4-3-13-26-15/h3-4,6-7,13H,2,5,8-12H2,1H3,(H,19,23)