6-(furan-2-yl)-5-nitro-N4-(3-phenylpropyl)pyrimidine-2,4-diamine

Systemtic Name: 6-(furan-2-yl)-5-nitro-N4-(3-phenylpropyl)pyrimidine-2,4-diamine Openeye Name: 6-(2-furyl)-5-nitro-N4-(3-phenylpropyl)pyrimidine-2,4-diamine CAS Name: 6-(2-furanyl)-5-nitro-N4-(3-phenylpropyl)pyrimidine-2,4-diamine IUPAC Name: 6-(furan-2-yl)-5-nitro-4-N-(3-phenylpropyl)pyrimidine-2,4-diamine Traditional Name: [2-amino-6-(2-furyl)-5-nitro-pyrimidin-4-yl]-(3-phenylpropyl)amine Formula: C17H17N5O3 MolecularWeight: 339.34858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC2=NC(=NC(=C2[N+](=O)[O-])C3=CC=CO3)N

Isomeric SMILES

C1=CC=C(C=C1)CCCNC2=NC(=NC(=C2[N+](=O)[O-])C3=CC=CO3)N

InChI

InChI=1S/C17H17N5O3/c18-17-20-14(13-9-5-11-25-13)15(22(23)24)16(21-17)19-10-4-8-12-6-2-1-3-7-12/h1-3,5-7,9,11H,4,8,10H2,(H3,18,19,20,21)