(8-chloranyl-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-yl)-thiophen-3-yl-methanone

Systemtic Name: (8-chloranyl-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-yl)-thiophen-3-yl-methanone Openeye Name: (8-chloro-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-yl)-(3-thienyl)methanone CAS Name: (8-chloro-5-oxido-3-pyrazolo[5,1-c][1,2,4]benzotriazin-5-iumyl)-(3-thiophenyl)methanone IUPAC Name: (8-chloro-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-yl)-thiophen-3-ylmethanone Traditional Name: (8-chloro-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-yl)-(3-thienyl)methanone Formula: C14H7ClN4O2S MolecularWeight: 330.74898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N3C(=C(C=N3)C(=O)C4=CSC=C4)N=[N+]2[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)N3C(=C(C=N3)C(=O)C4=CSC=C4)N=[N+]2[O-]

InChI

InChI=1S/C14H7ClN4O2S/c15-9-1-2-11-12(5-9)18-14(17-19(11)21)10(6-16-18)13(20)8-3-4-22-7-8/h1-7H