2-chloranyl-N-(6-ethyl-3-propyl-1,3-benzothiazol-2-ylidene)-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(6-ethyl-3-propyl-1,3-benzothiazol-2-ylidene)-5-nitro-benzamide Openeye Name: 2-chloro-N-(6-ethyl-3-propyl-1,3-benzothiazol-2-ylidene)-5-nitro-benzamide CAS Name: 2-chloro-N-(6-ethyl-3-propyl-1,3-benzothiazol-2-ylidene)-5-nitrobenzamide IUPAC Name: 2-chloro-N-(6-ethyl-3-propyl-1,3-benzothiazol-2-ylidene)-5-nitrobenzamide Traditional Name: 2-chloro-N-(6-ethyl-3-propyl-1,3-benzothiazol-2-ylidene)-5-nitro-benzamide Formula: C19H18ClN3O3S MolecularWeight: 403.88252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClN3O3S/c1-3-9-22-16-8-5-12(4-2)10-17(16)27-19(22)21-18(24)14-11-13(23(25)26)6-7-15(14)20/h5-8,10-11H,3-4,9H2,1-2H3