6-nitro-N-[(3-nitrophenyl)methyl]-2-(1,2-oxazol-5-yl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 6-nitro-N-[(3-nitrophenyl)methyl]-2-(1,2-oxazol-5-yl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 2-isoxazol-5-yl-6-nitro-N-[(3-nitrophenyl)methyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-(5-isoxazolyl)-6-nitro-N-[(3-nitrophenyl)methyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-nitro-N-[(3-nitrophenyl)methyl]-2-(1,2-oxazol-5-yl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: (2-isoxazol-5-yl-6-nitro-thieno[2,3-d]pyrimidin-4-yl)-(3-nitrobenzyl)amine Formula: C16H10N6O5S MolecularWeight: 398.3528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CNC2=C3C=C(SC3=NC(=N2)C4=CC=NO4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CNC2=C3C=C(SC3=NC(=N2)C4=CC=NO4)[N+](=O)[O-]

InChI

InChI=1S/C16H10N6O5S/c23-21(24)10-3-1-2-9(6-10)8-17-14-11-7-13(22(25)26)28-16(11)20-15(19-14)12-4-5-18-27-12/h1-7H,8H2,(H,17,19,20)