2-iodanyl-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 2-iodanyl-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 2-iodo-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 2-iodo-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 2-iodo-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 2-iodo-N-(6-nitro-3-propyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C17H14IN3O3S MolecularWeight: 467.28083

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=CC=C3I

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C17H14IN3O3S/c1-2-9-20-14-8-7-11(21(23)24)10-15(14)25-17(20)19-16(22)12-5-3-4-6-13(12)18/h3-8,10H,2,9H2,1H3