7-(4-azanyl-3-nitro-phenyl)-N-(3,4-dimethoxyphenyl)thieno[3,2-d]pyrimidin-2-amine

Systemtic Name: 7-(4-azanyl-3-nitro-phenyl)-N-(3,4-dimethoxyphenyl)thieno[3,2-d]pyrimidin-2-amine Openeye Name: 7-(4-amino-3-nitro-phenyl)-N-(3,4-dimethoxyphenyl)thieno[3,2-d]pyrimidin-2-amine CAS Name: 7-(4-amino-3-nitrophenyl)-N-(3,4-dimethoxyphenyl)-2-thieno[3,2-d]pyrimidinamine IUPAC Name: 7-(4-amino-3-nitrophenyl)-N-(3,4-dimethoxyphenyl)thieno[3,2-d]pyrimidin-2-amine Traditional Name: [7-(4-amino-3-nitro-phenyl)thieno[3,2-d]pyrimidin-2-yl]-(3,4-dimethoxyphenyl)amine Formula: C20H17N5O4S MolecularWeight: 423.44508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC=C3C(=N2)C(=CS3)C4=CC(=C(C=C4)N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC=C3C(=N2)C(=CS3)C4=CC(=C(C=C4)N)[N+](=O)[O-])OC

InChI

InChI=1S/C20H17N5O4S/c1-28-16-6-4-12(8-17(16)29-2)23-20-22-9-18-19(24-20)13(10-30-18)11-3-5-14(21)15(7-11)25(26)27/h3-10H,21H2,1-2H3,(H,22,23,24)