N-(5-nitro-1,3-thiazol-2-yl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-nitro-1,3-thiazol-2-yl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-nitrothiazol-2-yl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]acetamide CAS Name: N-(5-nitro-2-thiazolyl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)thio]acetamide IUPAC Name: N-(5-nitro-1,3-thiazol-2-yl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]acetamide Traditional Name: N-(5-nitrothiazol-2-yl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)thio]acetamide Formula: C13H11N6O3S2+ MolecularWeight: 363.39484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=C(N=CN2)SCC(=O)NC3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=C(N=CN2)SCC(=O)NC3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C13H10N6O3S2/c20-10(17-12-14-6-11(24-12)19(21)22)7-23-13-15-8-16-18(13)9-4-2-1-3-5-9/h1-6,8H,7H2,(H,14,17,20)/p+1