2-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]-N-(1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]-N-(1,3-benzodioxol-5-yl)ethanamide Openeye Name: 2-[2-acetamido-4-(2-methylthiazol-4-yl)phenoxy]-N-(1,3-benzodioxol-5-yl)acetamide CAS Name: 2-[2-acetamido-4-(2-methyl-4-thiazolyl)phenoxy]-N-(1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-[2-acetamido-4-(2-methyl-1,3-thiazol-4-yl)phenoxy]-N-(1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-[2-acetamido-4-(2-methylthiazol-4-yl)phenoxy]-N-(1,3-benzodioxol-5-yl)acetamide Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=C(C=C2)OCC(=O)NC3=CC4=C(C=C3)OCO4)NC(=O)C

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=C(C=C2)OCC(=O)NC3=CC4=C(C=C3)OCO4)NC(=O)C

InChI

InChI=1S/C21H19N3O5S/c1-12(25)22-16-7-14(17-10-30-13(2)23-17)3-5-18(16)27-9-21(26)24-15-4-6-19-20(8-15)29-11-28-19/h3-8,10H,9,11H2,1-2H3,(H,22,25)(H,24,26)