[5,6-dimethyl-4-(6-nitroindazol-1-yl)thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium

Systemtic Name: [5,6-dimethyl-4-(6-nitroindazol-1-yl)thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium Openeye Name: [5,6-dimethyl-4-(6-nitroindazol-1-yl)thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium CAS Name: [5,6-dimethyl-4-(6-nitro-1-indazolyl)-2-thieno[2,3-d]pyrimidinyl]methyl-diethylammonium IUPAC Name: [5,6-dimethyl-4-(6-nitroindazol-1-yl)thieno[2,3-d]pyrimidin-2-yl]methyl-diethylazanium Traditional Name: [5,6-dimethyl-4-(6-nitroindazol-1-yl)thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium Formula: C20H23N6O2S+ MolecularWeight: 411.50062

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)N3C4=C(C=CC(=C4)[N+](=O)[O-])C=N3

Isomeric SMILES

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)N3C4=C(C=CC(=C4)[N+](=O)[O-])C=N3

InChI

InChI=1S/C20H22N6O2S/c1-5-24(6-2)11-17-22-19(18-12(3)13(4)29-20(18)23-17)25-16-9-15(26(27)28)8-7-14(16)10-21-25/h7-10H,5-6,11H2,1-4H3/p+1