N4-[2-(1H-indol-3-yl)ethyl]-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[2-(1H-indol-3-yl)ethyl]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[2-(1H-indol-3-yl)ethyl]-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[2-(1H-indol-3-yl)ethyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[2-(1H-indol-3-yl)ethyl]-5-nitropyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-[2-(1H-indol-3-yl)ethyl]amine Formula: C14H14N6O2 MolecularWeight: 298.29996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNC3=NC=NC(=C3[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNC3=NC=NC(=C3[N+](=O)[O-])N

InChI

InChI=1S/C14H14N6O2/c15-13-12(20(21)22)14(19-8-18-13)16-6-5-9-7-17-11-4-2-1-3-10(9)11/h1-4,7-8,17H,5-6H2,(H3,15,16,18,19)