1-(5-fluoranyl-2-methyl-phenyl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-(5-fluoranyl-2-methyl-phenyl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-(5-fluoro-2-methyl-phenyl)sulfonyl-4-(p-tolylmethyl)-1,4-diazepane CAS Name: 1-(5-fluoro-2-methylphenyl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-(5-fluoro-2-methylphenyl)sulfonyl-4-[(4-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-(5-fluoro-2-methyl-phenyl)sulfonyl-4-(4-methylbenzyl)-1,4-diazepane Formula: C20H25FN2O2S MolecularWeight: 376.488103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)C

InChI

InChI=1S/C20H25FN2O2S/c1-16-4-7-18(8-5-16)15-22-10-3-11-23(13-12-22)26(24,25)20-14-19(21)9-6-17(20)2/h4-9,14H,3,10-13,15H2,1-2H3