1-(5-fluoranyl-2-methyl-phenyl)sulfonyl-4-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-1,4-diazepane

Systemtic Name: 1-(5-fluoranyl-2-methyl-phenyl)sulfonyl-4-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-1,4-diazepane Openeye Name: 1-(5-fluoro-2-methyl-phenyl)sulfonyl-4-[1-[(4-methoxyphenyl)methyl]-4-piperidyl]-1,4-diazepane CAS Name: 1-(5-fluoro-2-methylphenyl)sulfonyl-4-[1-[(4-methoxyphenyl)methyl]-4-piperidinyl]-1,4-diazepane IUPAC Name: 1-(5-fluoro-2-methylphenyl)sulfonyl-4-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-1,4-diazepane Traditional Name: 1-(5-fluoro-2-methyl-phenyl)sulfonyl-4-(1-p-anisyl-4-piperidyl)-1,4-diazepane Formula: C25H34FN3O3S MolecularWeight: 475.619163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)N2CCCN(CC2)C3CCN(CC3)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)N2CCCN(CC2)C3CCN(CC3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H34FN3O3S/c1-20-4-7-22(26)18-25(20)33(30,31)29-13-3-12-28(16-17-29)23-10-14-27(15-11-23)19-21-5-8-24(32-2)9-6-21/h4-9,18,23H,3,10-17,19H2,1-2H3