2-[(2E)-2-(5-azanylimidazol-4-ylidene)-4-methyl-3H-1,3-thiazol-5-yl]ethyl nitrate

Systemtic Name: 2-[(2E)-2-(5-azanylimidazol-4-ylidene)-4-methyl-3H-1,3-thiazol-5-yl]ethyl nitrate Openeye Name: 2-[(2E)-2-(5-aminoimidazol-4-ylidene)-4-methyl-3H-thiazol-5-yl]ethyl nitrate CAS Name: nitric acid 2-[(2E)-2-(5-amino-4-imidazolylidene)-4-methyl-3H-thiazol-5-yl]ethyl ester IUPAC Name: 2-[(2E)-2-(5-aminoimidazol-4-ylidene)-4-methyl-3H-1,3-thiazol-5-yl]ethyl nitrate Traditional Name: nitric acid 2-[(2E)-2-(5-aminoimidazol-4-ylidene)-4-methyl-4-thiazolin-5-yl]ethyl ester Formula: C9H11N5O3S MolecularWeight: 269.28034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C2C(=NC=N2)N)N1)CCO[N+](=O)[O-]

Isomeric SMILES

CC1=C(S/C(=C/2\C(=NC=N2)N)/N1)CCO[N+](=O)[O-]

InChI

InChI=1S/C9H11N5O3S/c1-5-6(2-3-17-14(15)16)18-9(13-5)7-8(10)12-4-11-7/h4,13H,2-3H2,1H3,(H2,10,11,12)/b9-7+