4-(4-bromophenyl)sulfonyl-2-(4-ethoxyphenyl)-5-[4-(phenylmethyl)piperidin-1-yl]-1,3-oxazole

Systemtic Name: 4-(4-bromophenyl)sulfonyl-2-(4-ethoxyphenyl)-5-[4-(phenylmethyl)piperidin-1-yl]-1,3-oxazole Openeye Name: 5-(4-benzyl-1-piperidyl)-4-(4-bromophenyl)sulfonyl-2-(4-ethoxyphenyl)oxazole CAS Name: 4-(4-bromophenyl)sulfonyl-2-(4-ethoxyphenyl)-5-[4-(phenylmethyl)-1-piperidinyl]oxazole IUPAC Name: 5-(4-benzylpiperidin-1-yl)-4-(4-bromophenyl)sulfonyl-2-(4-ethoxyphenyl)-1,3-oxazole Traditional Name: 5-(4-benzylpiperidino)-4-brosyl-2-p-phenetyl-oxazole Formula: C29H29BrN2O4S MolecularWeight: 581.52056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=C(O2)N3CCC(CC3)CC4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=C(O2)N3CCC(CC3)CC4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C29H29BrN2O4S/c1-2-35-25-12-8-23(9-13-25)27-31-28(37(33,34)26-14-10-24(30)11-15-26)29(36-27)32-18-16-22(17-19-32)20-21-6-4-3-5-7-21/h3-15,22H,2,16-20H2,1H3