N-[3-(6-bromanyl-1,2,3,4-tetrahydrocarbazol-9-yl)propyl]-4,6-dimethoxy-pyrimidin-2-amine

Systemtic Name: N-[3-(6-bromanyl-1,2,3,4-tetrahydrocarbazol-9-yl)propyl]-4,6-dimethoxy-pyrimidin-2-amine Openeye Name: N-[3-(6-bromo-1,2,3,4-tetrahydrocarbazol-9-yl)propyl]-4,6-dimethoxy-pyrimidin-2-amine CAS Name: N-[3-(6-bromo-1,2,3,4-tetrahydrocarbazol-9-yl)propyl]-4,6-dimethoxy-2-pyrimidinamine IUPAC Name: N-[3-(6-bromo-1,2,3,4-tetrahydrocarbazol-9-yl)propyl]-4,6-dimethoxypyrimidin-2-amine Traditional Name: 3-(6-bromo-1,2,3,4-tetrahydrocarbazol-9-yl)propyl-(4,6-dimethoxypyrimidin-2-yl)amine Formula: C21H25BrN4O2 MolecularWeight: 445.3528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NCCCN2C3=C(CCCC3)C4=C2C=CC(=C4)Br)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NCCCN2C3=C(CCCC3)C4=C2C=CC(=C4)Br)OC

InChI

InChI=1S/C21H25BrN4O2/c1-27-19-13-20(28-2)25-21(24-19)23-10-5-11-26-17-7-4-3-6-15(17)16-12-14(22)8-9-18(16)26/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,23,24,25)