2-imidazol-1-yl-6-nitro-N-[(3-nitrophenyl)methyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 2-imidazol-1-yl-6-nitro-N-[(3-nitrophenyl)methyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: 2-imidazol-1-yl-6-nitro-N-[(3-nitrophenyl)methyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-(1-imidazolyl)-6-nitro-N-[(3-nitrophenyl)methyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 2-imidazol-1-yl-6-nitro-N-[(3-nitrophenyl)methyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: (2-imidazol-1-yl-6-nitro-thieno[2,3-d]pyrimidin-4-yl)-(3-nitrobenzyl)amine Formula: C16H11N7O4S MolecularWeight: 397.36804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CNC2=C3C=C(SC3=NC(=N2)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CNC2=C3C=C(SC3=NC(=N2)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H11N7O4S/c24-22(25)11-3-1-2-10(6-11)8-18-14-12-7-13(23(26)27)28-15(12)20-16(19-14)21-5-4-17-9-21/h1-7,9H,8H2,(H,18,19,20)