[4-(4-fluoranyl-2-methyl-phenyl)sulfonyl-1,4-diazepan-1-yl]-(3-methylphenyl)methanone

Systemtic Name: [4-(4-fluoranyl-2-methyl-phenyl)sulfonyl-1,4-diazepan-1-yl]-(3-methylphenyl)methanone Openeye Name: [4-(4-fluoro-2-methyl-phenyl)sulfonyl-1,4-diazepan-1-yl]-(m-tolyl)methanone CAS Name: [4-(4-fluoro-2-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-(3-methylphenyl)methanone IUPAC Name: [4-(4-fluoro-2-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-(3-methylphenyl)methanone Traditional Name: [4-(4-fluoro-2-methyl-phenyl)sulfonyl-1,4-diazepan-1-yl]-(m-tolyl)methanone Formula: C20H23FN2O3S MolecularWeight: 390.471623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)F)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)F)C

InChI

InChI=1S/C20H23FN2O3S/c1-15-5-3-6-17(13-15)20(24)22-9-4-10-23(12-11-22)27(25,26)19-8-7-18(21)14-16(19)2/h3,5-8,13-14H,4,9-12H2,1-2H3