6-chloranyl-N-heptyl-2-methyl-5-nitro-N-(phenylmethyl)pyrimidin-4-amine

Systemtic Name: 6-chloranyl-N-heptyl-2-methyl-5-nitro-N-(phenylmethyl)pyrimidin-4-amine Openeye Name: N-benzyl-6-chloro-N-heptyl-2-methyl-5-nitro-pyrimidin-4-amine CAS Name: 6-chloro-N-heptyl-2-methyl-5-nitro-N-(phenylmethyl)-4-pyrimidinamine IUPAC Name: N-benzyl-6-chloro-N-heptyl-2-methyl-5-nitropyrimidin-4-amine Traditional Name: benzyl-(6-chloro-2-methyl-5-nitro-pyrimidin-4-yl)-heptyl-amine Formula: C19H25ClN4O2 MolecularWeight: 376.8804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=CC=C1)C2=C(C(=NC(=N2)C)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCN(CC1=CC=CC=C1)C2=C(C(=NC(=N2)C)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H25ClN4O2/c1-3-4-5-6-10-13-23(14-16-11-8-7-9-12-16)19-17(24(25)26)18(20)21-15(2)22-19/h7-9,11-12H,3-6,10,13-14H2,1-2H3