2-methyl-1-[4-(3-piperidin-1-ylsulfonylthiophen-2-yl)carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-(3-piperidin-1-ylsulfonylthiophen-2-yl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-[3-(1-piperidylsulfonyl)thiophene-2-carbonyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[oxo-[3-(1-piperidinylsulfonyl)-2-thiophenyl]methyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-(3-piperidin-1-ylsulfonylthiophene-2-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-(3-piperidinosulfonylthiophene-2-carbonyl)piperazino]propan-1-one Formula: C18H27N3O4S2 MolecularWeight: 413.55468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H27N3O4S2/c1-14(2)17(22)19-9-11-20(12-10-19)18(23)16-15(6-13-26-16)27(24,25)21-7-4-3-5-8-21/h6,13-14H,3-5,7-12H2,1-2H3