5-(azepan-1-yl)-4-(4-bromophenyl)sulfonyl-2-(4-ethoxyphenyl)-1,3-oxazole

Systemtic Name: 5-(azepan-1-yl)-4-(4-bromophenyl)sulfonyl-2-(4-ethoxyphenyl)-1,3-oxazole Openeye Name: 5-(azepan-1-yl)-4-(4-bromophenyl)sulfonyl-2-(4-ethoxyphenyl)oxazole CAS Name: 5-(1-azepanyl)-4-(4-bromophenyl)sulfonyl-2-(4-ethoxyphenyl)oxazole IUPAC Name: 5-(azepan-1-yl)-4-(4-bromophenyl)sulfonyl-2-(4-ethoxyphenyl)-1,3-oxazole Traditional Name: 5-(azepan-1-yl)-4-brosyl-2-p-phenetyl-oxazole Formula: C23H25BrN2O4S MolecularWeight: 505.4246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(O2)N3CCCCCC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(O2)N3CCCCCC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H25BrN2O4S/c1-2-29-19-11-7-17(8-12-19)21-25-22(23(30-21)26-15-5-3-4-6-16-26)31(27,28)20-13-9-18(24)10-14-20/h7-14H,2-6,15-16H2,1H3