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

Systemtic Name: [4-[[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonyl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[(5S)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[(5S)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[(5S)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]piperazino]-(2-thienyl)methanone Formula: C22H28N2O2S2 MolecularWeight: 416.59992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H28N2O2S2/c1-22(2,3)16-6-7-17-15(13-16)14-19(28-17)21(26)24-10-8-23(9-11-24)20(25)18-5-4-12-27-18/h4-5,12,14,16H,6-11,13H2,1-3H3/t16-/m0/s1