3,4,5-triethoxy-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 3,4,5-triethoxy-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 3,4,5-triethoxy-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 3,4,5-triethoxy-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 3,4,5-triethoxy-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 3,4,5-triethoxy-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC(=C(C(=C3)OCC)OCC)OCC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC(=C(C(=C3)OCC)OCC)OCC

InChI

InChI=1S/C23H27N3O6S/c1-5-11-25-17-10-9-16(26(28)29)14-20(17)33-23(25)24-22(27)15-12-18(30-6-2)21(32-8-4)19(13-15)31-7-3/h9-10,12-14H,5-8,11H2,1-4H3