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

Systemtic Name: 2-(3-methyl-4-propan-2-yl-phenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(4-isopropyl-3-methyl-phenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(3-methyl-4-propan-2-ylphenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(3-methyl-4-propan-2-ylphenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(4-isopropyl-3-methyl-phenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C19H19N3O4S/c1-11(2)15-6-5-14(8-12(15)3)26-10-18(23)21-19-20-16-7-4-13(22(24)25)9-17(16)27-19/h4-9,11H,10H2,1-3H3,(H,20,21,23)