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

Systemtic Name: 5-(azepan-1-yl)-2-(4-ethoxyphenyl)-4-(phenylsulfonyl)-1,3-oxazole Openeye Name: 5-(azepan-1-yl)-4-(benzenesulfonyl)-2-(4-ethoxyphenyl)oxazole CAS Name: 5-(1-azepanyl)-4-(benzenesulfonyl)-2-(4-ethoxyphenyl)oxazole IUPAC Name: 5-(azepan-1-yl)-4-(benzenesulfonyl)-2-(4-ethoxyphenyl)-1,3-oxazole Traditional Name: 5-(azepan-1-yl)-4-besyl-2-p-phenetyl-oxazole Formula: C23H26N2O4S MolecularWeight: 426.52854

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O4S/c1-2-28-19-14-12-18(13-15-19)21-24-22(30(26,27)20-10-6-5-7-11-20)23(29-21)25-16-8-3-4-9-17-25/h5-7,10-15H,2-4,8-9,16-17H2,1H3