N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-1,2-oxazole-3-carboxamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)isoxazole-3-carboxamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-3-isoxazolecarboxamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-1,2-oxazole-3-carboxamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-p-phenetyl-isoxazole-3-carboxamide Formula: C21H19N3O4S MolecularWeight: 409.45826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC3=NC4=C(S3)C=C(C=C4)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC3=NC4=C(S3)C=C(C=C4)OCC

InChI

InChI=1S/C21H19N3O4S/c1-3-26-14-7-5-13(6-8-14)18-12-17(24-28-18)20(25)23-21-22-16-10-9-15(27-4-2)11-19(16)29-21/h5-12H,3-4H2,1-2H3,(H,22,23,25)