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

Systemtic Name: 5-nitro-N4-(phenylmethyl)-N4-propan-2-yl-pyrimidine-4,6-diamine Openeye Name: N4-benzyl-N4-isopropyl-5-nitro-pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-(phenylmethyl)-N4-propan-2-ylpyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-5-nitro-4-N-propan-2-ylpyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-benzyl-isopropyl-amine Formula: C14H17N5O2 MolecularWeight: 287.31708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N

InChI

InChI=1S/C14H17N5O2/c1-10(2)18(8-11-6-4-3-5-7-11)14-12(19(20)21)13(15)16-9-17-14/h3-7,9-10H,8H2,1-2H3,(H2,15,16,17)