[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone

Systemtic Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone Openeye Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-[3-(1-piperidylsulfonyl)-2-thienyl]methanone CAS Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-[3-(1-piperidinylsulfonyl)-2-thiophenyl]methanone IUPAC Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone Traditional Name: [4-(4-fluorobenzyl)-1,4-diazepan-1-yl]-(3-piperidinosulfonyl-2-thienyl)methanone Formula: C22H28FN3O3S2 MolecularWeight: 465.604423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(SC=C2)C(=O)N3CCCN(CC3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(SC=C2)C(=O)N3CCCN(CC3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C22H28FN3O3S2/c23-19-7-5-18(6-8-19)17-24-10-4-11-25(15-14-24)22(27)21-20(9-16-30-21)31(28,29)26-12-2-1-3-13-26/h5-9,16H,1-4,10-15,17H2