2-(3-methyl-1H-benzimidazol-2-ylidene)-3-(5-nitrothiophen-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(3-methyl-1H-benzimidazol-2-ylidene)-3-(5-nitrothiophen-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: 2-(3-methyl-1H-benzimidazol-2-ylidene)-3-(5-nitro-2-thienyl)-3-oxo-propanenitrile CAS Name: 2-(3-methyl-1H-benzimidazol-2-ylidene)-3-(5-nitro-2-thiophenyl)-3-oxopropanenitrile IUPAC Name: 2-(3-methyl-1H-benzimidazol-2-ylidene)-3-(5-nitrothiophen-2-yl)-3-oxopropanenitrile Traditional Name: 3-keto-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-(5-nitro-2-thienyl)propionitrile Formula: C15H10N4O3S MolecularWeight: 326.3299

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2NC1=C(C#N)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2NC1=C(C#N)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C15H10N4O3S/c1-18-11-5-3-2-4-10(11)17-15(18)9(8-16)14(20)12-6-7-13(23-12)19(21)22/h2-7,17H,1H3