N4,N6-bis(9-ethylcarbazol-3-yl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4,N6-bis(9-ethylcarbazol-3-yl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4,N6-bis(9-ethylcarbazol-3-yl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4,N6-bis(9-ethyl-3-carbazolyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N,6-N-bis(9-ethylcarbazol-3-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: (9-ethylcarbazol-3-yl)-[6-[(9-ethylcarbazol-3-yl)amino]-5-nitro-pyrimidin-4-yl]amine Formula: C32H27N7O2 MolecularWeight: 541.60248

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC3=C(C(=NC=N3)NC4=CC5=C(C=C4)N(C6=CC=CC=C65)CC)[N+](=O)[O-])C7=CC=CC=C71

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC3=C(C(=NC=N3)NC4=CC5=C(C=C4)N(C6=CC=CC=C65)CC)[N+](=O)[O-])C7=CC=CC=C71

InChI

InChI=1S/C32H27N7O2/c1-3-37-26-11-7-5-9-22(26)24-17-20(13-15-28(24)37)35-31-30(39(40)41)32(34-19-33-31)36-21-14-16-29-25(18-21)23-10-6-8-12-27(23)38(29)4-2/h5-19H,3-4H2,1-2H3,(H2,33,34,35,36)