N-[(2S)-octan-2-yl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide

Systemtic Name: N-[(2S)-octan-2-yl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide Openeye Name: N-[(1S)-1-methylheptyl]-2-[4-(2-thienylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-[(2S)-octan-2-yl]-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)acetamide IUPAC Name: N-[(2S)-octan-2-yl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide Traditional Name: N-[(1S)-1-methylheptyl]-2-[4-(2-thienylsulfonyl)piperazino]acetamide Formula: C18H31N3O3S2 MolecularWeight: 401.58704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CCCCCC[C@H](C)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C18H31N3O3S2/c1-3-4-5-6-8-16(2)19-17(22)15-20-10-12-21(13-11-20)26(23,24)18-9-7-14-25-18/h7,9,14,16H,3-6,8,10-13,15H2,1-2H3,(H,19,22)/t16-/m0/s1