1-[4-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[(5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[(5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]piperazino]ethanone Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C16H22N2O2S/c1-11-3-4-14-13(9-11)10-15(21-14)16(20)18-7-5-17(6-8-18)12(2)19/h10-11H,3-9H2,1-2H3/t11-/m0/s1