N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxy-3-methyl-phenyl)ethanamide

Systemtic Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxy-3-methyl-phenyl)ethanamide Openeye Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxy-3-methyl-phenyl)acetamide CAS Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxy-3-methylphenyl)acetamide IUPAC Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxy-3-methylphenyl)acetamide Traditional Name: N-[3-(2-ethoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-(4-methoxy-3-methyl-phenyl)acetamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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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)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O5S/c1-4-29-10-9-23-17-13-16(24(26)27)6-8-19(17)30-21(23)22-20(25)12-15-5-7-18(28-3)14(2)11-15/h5-8,11,13H,4,9-10,12H2,1-3H3