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

Systemtic Name: N-[6-[(6-chloranylpyridin-3-yl)methyl-ethyl-amino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-4-methyl-benzamide Openeye Name: N-[6-[(6-chloro-3-pyridyl)methyl-ethyl-amino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-4-methyl-benzamide CAS Name: N-[6-[(6-chloro-3-pyridinyl)methyl-ethylamino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-4-methylbenzamide IUPAC Name: N-[6-[(6-chloropyridin-3-yl)methyl-ethylamino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-4-methylbenzamide Traditional Name: N-[6-[(6-chloro-3-pyridyl)methyl-ethyl-amino]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]-4-methyl-benzamide Formula: C21H25ClN6O3 MolecularWeight: 444.9146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN6O3/c1-4-26(12-16-7-10-19(22)23-11-16)21-18(28(30)31)13-27(14-25(21)3)24-20(29)17-8-5-15(2)6-9-17/h5-11H,4,12-14H2,1-3H3,(H,24,29)