N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-(5-methyl-2-propan-2-yl-phenoxy)ethanamide

Systemtic Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-(5-methyl-2-propan-2-yl-phenoxy)ethanamide Openeye Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide IUPAC Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H21N3O5S/c1-11(2)14-6-5-12(3)7-15(14)28-10-18(24)21-20-22-19-16(27-4)8-13(23(25)26)9-17(19)29-20/h5-9,11H,10H2,1-4H3,(H,21,22,24)