[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(1-methylsulfonylpiperidin-2-yl)methanone

Systemtic Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(1-methylsulfonylpiperidin-2-yl)methanone Openeye Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(1-methylsulfonyl-2-piperidyl)methanone CAS Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(1-methylsulfonyl-2-piperidinyl)methanone IUPAC Name: [4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-(1-methylsulfonylpiperidin-2-yl)methanone Traditional Name: [4-(4-fluorobenzyl)-1,4-diazepan-1-yl]-(1-mesyl-2-piperidyl)methanone Formula: C19H28FN3O3S MolecularWeight: 397.507323

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCCC1C(=O)N2CCCN(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CS(=O)(=O)N1CCCCC1C(=O)N2CCCN(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C19H28FN3O3S/c1-27(25,26)23-12-3-2-5-18(23)19(24)22-11-4-10-21(13-14-22)15-16-6-8-17(20)9-7-16/h6-9,18H,2-5,10-15H2,1H3