[4-(phenylmethyl)sulfonylpiperazin-1-yl]-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone

Systemtic Name: [4-(phenylmethyl)sulfonylpiperazin-1-yl]-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-(4,5,6,7-tetrahydrobenzothiophen-2-yl)methanone CAS Name: [4-(phenylmethyl)sulfonyl-1-piperazinyl]-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Traditional Name: (4-benzylsulfonylpiperazino)-(4,5,6,7-tetrahydrobenzothiophen-2-yl)methanone Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C20H24N2O3S2/c23-20(19-14-17-8-4-5-9-18(17)26-19)21-10-12-22(13-11-21)27(24,25)15-16-6-2-1-3-7-16/h1-3,6-7,14H,4-5,8-13,15H2