1-(1,3-benzothiazol-2-ylmethyl)-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-(1,3-benzothiazol-2-ylmethyl)-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-(1,3-benzothiazol-2-ylmethyl)-5-nitro-2-oxo-pyridine-3-carbonitrile CAS Name: 1-(1,3-benzothiazol-2-ylmethyl)-5-nitro-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-(1,3-benzothiazol-2-ylmethyl)-5-nitro-2-oxopyridine-3-carbonitrile Traditional Name: 1-(1,3-benzothiazol-2-ylmethyl)-2-keto-5-nitro-nicotinonitrile Formula: C14H8N4O3S MolecularWeight: 312.30332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-]

InChI

InChI=1S/C14H8N4O3S/c15-6-9-5-10(18(20)21)7-17(14(9)19)8-13-16-11-3-1-2-4-12(11)22-13/h1-5,7H,8H2