4-[[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonyl]piperazin-2-one

Systemtic Name: 4-[[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonyl]piperazin-2-one Openeye Name: 4-[(5S)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]piperazin-2-one CAS Name: 4-[[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]-2-piperazinone IUPAC Name: 4-[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]piperazin-2-one Traditional Name: 4-[(5S)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]piperazin-2-one Formula: C17H24N2O2S MolecularWeight: 320.44966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)N3CCNC(=O)C3

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=C(C1)C=C(S2)C(=O)N3CCNC(=O)C3

InChI

InChI=1S/C17H24N2O2S/c1-17(2,3)12-4-5-13-11(8-12)9-14(22-13)16(21)19-7-6-18-15(20)10-19/h9,12H,4-8,10H2,1-3H3,(H,18,20)/t12-/m0/s1