2-[4-methyl-2-(pyridin-3-ylmethylamino)-1,3-thiazol-5-yl]ethyl nitrate

Systemtic Name: 2-[4-methyl-2-(pyridin-3-ylmethylamino)-1,3-thiazol-5-yl]ethyl nitrate Openeye Name: 2-[4-methyl-2-(3-pyridylmethylamino)thiazol-5-yl]ethyl nitrate CAS Name: nitric acid 2-[4-methyl-2-(3-pyridinylmethylamino)-5-thiazolyl]ethyl ester IUPAC Name: 2-[4-methyl-2-(pyridin-3-ylmethylamino)-1,3-thiazol-5-yl]ethyl nitrate Traditional Name: nitric acid 2-[4-methyl-2-(3-pyridylmethylamino)thiazol-5-yl]ethyl ester Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NCC2=CN=CC=C2)CCO[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)NCC2=CN=CC=C2)CCO[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O3S/c1-9-11(4-6-19-16(17)18)20-12(15-9)14-8-10-3-2-5-13-7-10/h2-3,5,7H,4,6,8H2,1H3,(H,14,15)