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

Systemtic Name: 2-[2-[4-(dimethylamino)pyridin-3-yl]-4-methyl-1,3-thiazol-5-yl]ethyl nitrate Openeye Name: 2-[2-[4-(dimethylamino)-3-pyridyl]-4-methyl-thiazol-5-yl]ethyl nitrate CAS Name: nitric acid 2-[2-[4-(dimethylamino)-3-pyridinyl]-4-methyl-5-thiazolyl]ethyl ester IUPAC Name: 2-[2-[4-(dimethylamino)pyridin-3-yl]-4-methyl-1,3-thiazol-5-yl]ethyl nitrate Traditional Name: nitric acid 2-[2-[4-(dimethylamino)-3-pyridyl]-4-methyl-thiazol-5-yl]ethyl ester Formula: C13H16N4O3S MolecularWeight: 308.35614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N4O3S/c1-9-12(5-7-20-17(18)19)21-13(15-9)10-8-14-6-4-11(10)16(2)3/h4,6,8H,5,7H2,1-3H3