N4-(2-fluorophenyl)-5-nitro-N6-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-(2-fluorophenyl)-5-nitro-N6-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine Openeye Name: N4-(2-fluorophenyl)-5-nitro-N6-[2-(2-thienyl)ethyl]pyrimidine-4,6-diamine CAS Name: N4-(2-fluorophenyl)-5-nitro-N6-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(2-fluorophenyl)-5-nitro-6-N-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine Traditional Name: [6-(2-fluoroanilino)-5-nitro-pyrimidin-4-yl]-[2-(2-thienyl)ethyl]amine Formula: C16H14FN5O2S MolecularWeight: 359.378063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=C(C(=NC=N2)NCCC3=CC=CS3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)NC2=C(C(=NC=N2)NCCC3=CC=CS3)[N+](=O)[O-])F

InChI

InChI=1S/C16H14FN5O2S/c17-12-5-1-2-6-13(12)21-16-14(22(23)24)15(19-10-20-16)18-8-7-11-4-3-9-25-11/h1-6,9-10H,7-8H2,(H2,18,19,20,21)