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

Systemtic Name: 5-(azepan-1-yl)-4-(4-chlorophenyl)sulfonyl-2-(2-methylphenyl)-1,3-oxazole Openeye Name: 5-(azepan-1-yl)-4-(4-chlorophenyl)sulfonyl-2-(o-tolyl)oxazole CAS Name: 5-(1-azepanyl)-4-(4-chlorophenyl)sulfonyl-2-(2-methylphenyl)oxazole IUPAC Name: 5-(azepan-1-yl)-4-(4-chlorophenyl)sulfonyl-2-(2-methylphenyl)-1,3-oxazole Traditional Name: 5-(azepan-1-yl)-4-(4-chlorophenyl)sulfonyl-2-(o-tolyl)oxazole Formula: C22H23ClN2O3S MolecularWeight: 430.94762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN2O3S/c1-16-8-4-5-9-19(16)20-24-21(22(28-20)25-14-6-2-3-7-15-25)29(26,27)18-12-10-17(23)11-13-18/h4-5,8-13H,2-3,6-7,14-15H2,1H3