N,N-bis(2-methylpropyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine

Systemtic Name: N,N-bis(2-methylpropyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Openeye Name: N,N-diisobutyl-6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N,N-bis(2-methylpropyl)-5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinamine IUPAC Name: N,N-bis(2-methylpropyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Traditional Name: diisobutyl-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=C(C(=NC=N1)OC2=CC=C(C=C2)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(CC(C)C)C1=C(C(=NC=N1)OC2=CC=C(C=C2)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H30N4O3/c1-14(2)11-24(12-15(3)4)20-19(25(26)27)21(23-13-22-20)28-18-9-7-17(8-10-18)16(5)6/h7-10,13-16H,11-12H2,1-6H3