5-(azepan-1-yl)-2-(2-methylphenyl)-4-(phenylsulfonyl)-1,3-oxazole

Systemtic Name: 5-(azepan-1-yl)-2-(2-methylphenyl)-4-(phenylsulfonyl)-1,3-oxazole Openeye Name: 5-(azepan-1-yl)-4-(benzenesulfonyl)-2-(o-tolyl)oxazole CAS Name: 5-(1-azepanyl)-4-(benzenesulfonyl)-2-(2-methylphenyl)oxazole IUPAC Name: 5-(azepan-1-yl)-4-(benzenesulfonyl)-2-(2-methylphenyl)-1,3-oxazole Traditional Name: 5-(azepan-1-yl)-4-besyl-2-(o-tolyl)oxazole Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=C(O2)N3CCCCCC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=C(O2)N3CCCCCC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H24N2O3S/c1-17-11-7-8-14-19(17)20-23-21(28(25,26)18-12-5-4-6-13-18)22(27-20)24-15-9-2-3-10-16-24/h4-8,11-14H,2-3,9-10,15-16H2,1H3