N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-propan-2-ylphenyl)ethanamide

Systemtic Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-propan-2-ylphenyl)ethanamide Openeye Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-isopropylphenyl)acetamide CAS Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-propan-2-ylphenyl)acetamide IUPAC Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-propan-2-ylphenyl)acetamide Traditional Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-p-cumenyl-acetamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCOCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H25N3O4S/c1-4-29-12-11-24-19-14-18(25(27)28)9-10-20(19)30-22(24)23-21(26)13-16-5-7-17(8-6-16)15(2)3/h5-10,14-15H,4,11-13H2,1-3H3