[5,6-dimethyl-4-(2-nitropyridin-3-yl)oxy-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium

Systemtic Name: [5,6-dimethyl-4-(2-nitropyridin-3-yl)oxy-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium Openeye Name: [5,6-dimethyl-4-[(2-nitro-3-pyridyl)oxy]thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium CAS Name: [5,6-dimethyl-4-[(2-nitro-3-pyridinyl)oxy]-2-thieno[2,3-d]pyrimidinyl]methyl-diethylammonium IUPAC Name: [5,6-dimethyl-4-(2-nitropyridin-3-yl)oxythieno[2,3-d]pyrimidin-2-yl]methyl-diethylazanium Traditional Name: [5,6-dimethyl-4-[(2-nitro-3-pyridyl)oxy]thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium Formula: C18H22N5O3S+ MolecularWeight: 388.46398

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)OC3=C(N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)OC3=C(N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O3S/c1-5-22(6-2)10-14-20-17(15-11(3)12(4)27-18(15)21-14)26-13-8-7-9-19-16(13)23(24)25/h7-9H,5-6,10H2,1-4H3/p+1