5-nitro-N4,N4-bis(phenylmethyl)-N6-propan-2-yl-pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4,N4-bis(phenylmethyl)-N6-propan-2-yl-pyrimidine-4,6-diamine Openeye Name: N4,N4-dibenzyl-N6-isopropyl-5-nitro-pyrimidine-4,6-diamine CAS Name: 5-nitro-N4,N4-bis(phenylmethyl)-N6-propan-2-ylpyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dibenzyl-5-nitro-6-N-propan-2-ylpyrimidine-4,6-diamine Traditional Name: dibenzyl-[6-(isopropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C(=NC=N1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC1=C(C(=NC=N1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O2/c1-16(2)24-20-19(26(27)28)21(23-15-22-20)25(13-17-9-5-3-6-10-17)14-18-11-7-4-8-12-18/h3-12,15-16H,13-14H2,1-2H3,(H,22,23,24)