phenyl-[4-(3-piperidin-1-ylsulfonylthiophen-2-yl)carbonylpiperazin-1-yl]methanone

Systemtic Name: phenyl-[4-(3-piperidin-1-ylsulfonylthiophen-2-yl)carbonylpiperazin-1-yl]methanone Openeye Name: phenyl-[4-[3-(1-piperidylsulfonyl)thiophene-2-carbonyl]piperazin-1-yl]methanone CAS Name: [4-[oxo-[3-(1-piperidinylsulfonyl)-2-thiophenyl]methyl]-1-piperazinyl]-phenylmethanone IUPAC Name: phenyl-[4-(3-piperidin-1-ylsulfonylthiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: phenyl-[4-(3-piperidinosulfonylthiophene-2-carbonyl)piperazino]methanone Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(SC=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(SC=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O4S2/c25-20(17-7-3-1-4-8-17)22-12-14-23(15-13-22)21(26)19-18(9-16-29-19)30(27,28)24-10-5-2-6-11-24/h1,3-4,7-9,16H,2,5-6,10-15H2