2-(3H-1,3-benzothiazol-2-ylidene)-3-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]-3-oxidanylidene-propanenitrile Openeye Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-[5-(2-chloro-4-nitro-phenyl)-2-furyl]-3-oxo-propanenitrile CAS Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-[5-(2-chloro-4-nitrophenyl)-2-furanyl]-3-oxopropanenitrile IUPAC Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-3-oxopropanenitrile Traditional Name: 2-(3H-1,3-benzothiazol-2-ylidene)-3-[5-(2-chloro-4-nitro-phenyl)-2-furyl]-3-keto-propionitrile Formula: C20H10ClN3O4S MolecularWeight: 423.8291

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)S2

InChI

InChI=1S/C20H10ClN3O4S/c21-14-9-11(24(26)27)5-6-12(14)16-7-8-17(28-16)19(25)13(10-22)20-23-15-3-1-2-4-18(15)29-20/h1-9,23H