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

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-(2-methylimidazol-1-yl)-6-nitro-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[(4-fluorophenyl)methyl]-2-(2-methylimidazol-1-yl)-6-nitro-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(4-fluorophenyl)methyl]-2-(2-methyl-1-imidazolyl)-6-nitro-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[(4-fluorophenyl)methyl]-2-(2-methylimidazol-1-yl)-6-nitrothieno[2,3-d]pyrimidin-4-amine Traditional Name: (4-fluorobenzyl)-[2-(2-methylimidazol-1-yl)-6-nitro-thieno[2,3-d]pyrimidin-4-yl]amine Formula: C17H13FN6O2S MolecularWeight: 384.387523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=NC(=C3C=C(SC3=N2)[N+](=O)[O-])NCC4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC=CN1C2=NC(=C3C=C(SC3=N2)[N+](=O)[O-])NCC4=CC=C(C=C4)F

InChI

InChI=1S/C17H13FN6O2S/c1-10-19-6-7-23(10)17-21-15(20-9-11-2-4-12(18)5-3-11)13-8-14(24(25)26)27-16(13)22-17/h2-8H,9H2,1H3,(H,20,21,22)