4-tert-butyl-N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-tert-butyl-N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-tert-butyl-N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-tert-butyl-N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-tert-butyl-N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-tert-butyl-N-(3-ethyl-5-nitro-1,3-benzothiazol-2-ylidene)benzamide Formula: C20H21N3O3S MolecularWeight: 383.46404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C20H21N3O3S/c1-5-22-16-12-15(23(25)26)10-11-17(16)27-19(22)21-18(24)13-6-8-14(9-7-13)20(2,3)4/h6-12H,5H2,1-4H3