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

Systemtic Name: 2-imidazol-1-yl-6-nitro-N-(phenylmethyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-benzyl-2-imidazol-1-yl-6-nitro-thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-(1-imidazolyl)-6-nitro-N-(phenylmethyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-benzyl-2-imidazol-1-yl-6-nitrothieno[2,3-d]pyrimidin-4-amine Traditional Name: benzyl-(2-imidazol-1-yl-6-nitro-thieno[2,3-d]pyrimidin-4-yl)amine Formula: C16H12N6O2S MolecularWeight: 352.37048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N6O2S/c23-22(24)13-8-12-14(18-9-11-4-2-1-3-5-11)19-16(20-15(12)25-13)21-7-6-17-10-21/h1-8,10H,9H2,(H,18,19,20)