6-nitro-5-(2-thiophen-2-ylethenyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 6-nitro-5-(2-thiophen-2-ylethenyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 6-nitro-5-[2-(2-thienyl)vinyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 6-nitro-5-(2-thiophen-2-ylethenyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 6-nitro-5-(2-thiophen-2-ylethenyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 6-nitro-5-[2-(2-thienyl)vinyl]-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C11H7N5O3S MolecularWeight: 289.26998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC2=C(C(=O)N3C(=N2)N=CN3)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C=CC2=C(C(=O)N3C(=N2)N=CN3)[N+](=O)[O-]

InChI

InChI=1S/C11H7N5O3S/c17-10-9(16(18)19)8(4-3-7-2-1-5-20-7)14-11-12-6-13-15(10)11/h1-6H,(H,12,13,14)