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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)S(=O)(=O)N2CCCN(CC2)CC3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=C(C=C1)F)S(=O)(=O)N2CCCN(CC2)CC3=CC=CC=C3C

InChI

InChI=1S/C20H25FN2O2S/c1-16-8-9-19(21)20(14-16)26(24,25)23-11-5-10-22(12-13-23)15-18-7-4-3-6-17(18)2/h3-4,6-9,14H,5,10-13,15H2,1-2H3