2-bromanyl-N-[6-[(6-chloranylpyridin-3-yl)methyl-ethyl-amino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-5-methoxy-benzamide

Systemtic Name: 2-bromanyl-N-[6-[(6-chloranylpyridin-3-yl)methyl-ethyl-amino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-5-methoxy-benzamide Openeye Name: 2-bromo-N-[6-[(6-chloro-3-pyridyl)methyl-ethyl-amino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-5-methoxy-benzamide CAS Name: 2-bromo-N-[6-[(6-chloro-3-pyridinyl)methyl-ethylamino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-5-methoxybenzamide IUPAC Name: 2-bromo-N-[6-[(6-chloropyridin-3-yl)methyl-ethylamino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-5-methoxybenzamide Traditional Name: 2-bromo-N-[6-[(6-chloro-3-pyridyl)methyl-ethyl-amino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-5-methoxy-benzamide Formula: C21H24BrClN6O4 MolecularWeight: 539.81006

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CN=C(C=C1)Cl)C2=C(CN(CN2C)NC(=O)C3=C(C=CC(=C3)OC)Br)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CN=C(C=C1)Cl)C2=C(CN(CN2C)NC(=O)C3=C(C=CC(=C3)OC)Br)[N+](=O)[O-]

InChI

InChI=1S/C21H24BrClN6O4/c1-4-27(11-14-5-8-19(23)24-10-14)21-18(29(31)32)12-28(13-26(21)2)25-20(30)16-9-15(33-3)6-7-17(16)22/h5-10H,4,11-13H2,1-3H3,(H,25,30)