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

Systemtic Name: 5-(azepan-1-yl)-4-(4-chlorophenyl)sulfonyl-2-(4-methoxyphenyl)-1,3-oxazole Openeye Name: 5-(azepan-1-yl)-4-(4-chlorophenyl)sulfonyl-2-(4-methoxyphenyl)oxazole CAS Name: 5-(1-azepanyl)-4-(4-chlorophenyl)sulfonyl-2-(4-methoxyphenyl)oxazole IUPAC Name: 5-(azepan-1-yl)-4-(4-chlorophenyl)sulfonyl-2-(4-methoxyphenyl)-1,3-oxazole Traditional Name: 5-(azepan-1-yl)-4-(4-chlorophenyl)sulfonyl-2-(4-methoxyphenyl)oxazole Formula: C22H23ClN2O4S MolecularWeight: 446.94702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(O2)N3CCCCCC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(O2)N3CCCCCC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H23ClN2O4S/c1-28-18-10-6-16(7-11-18)20-24-21(22(29-20)25-14-4-2-3-5-15-25)30(26,27)19-12-8-17(23)9-13-19/h6-13H,2-5,14-15H2,1H3