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

Systemtic Name: N-[(4-fluorophenyl)methyl]-6-nitro-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[(4-fluorophenyl)methyl]-6-nitro-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(4-fluorophenyl)methyl]-6-nitro-2-(1-pyrazolyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[(4-fluorophenyl)methyl]-6-nitro-2-pyrazol-1-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (4-fluorobenzyl)-(6-nitro-2-pyrazol-1-yl-thieno[2,3-d]pyrimidin-4-yl)amine Formula: C16H11FN6O2S MolecularWeight: 370.360943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=NC(=C3C=C(SC3=N2)[N+](=O)[O-])NCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CN(N=C1)C2=NC(=C3C=C(SC3=N2)[N+](=O)[O-])NCC4=CC=C(C=C4)F

InChI

InChI=1S/C16H11FN6O2S/c17-11-4-2-10(3-5-11)9-18-14-12-8-13(23(24)25)26-15(12)21-16(20-14)22-7-1-6-19-22/h1-8H,9H2,(H,18,20,21)