N-(3-azanylpropyl)-N-[1-[5-[2,3-bis(fluoranyl)phenyl]-4-methyl-6-oxidanylidene-1-(phenylmethyl)pyrimidin-2-yl]-2-methyl-propyl]-4-methyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[1-[5-[2,3-bis(fluoranyl)phenyl]-4-methyl-6-oxidanylidene-1-(phenylmethyl)pyrimidin-2-yl]-2-methyl-propyl]-4-methyl-benzamide Openeye Name: N-(3-aminopropyl)-N-[1-[1-benzyl-5-(2,3-difluorophenyl)-4-methyl-6-oxo-pyrimidin-2-yl]-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-(3-aminopropyl)-N-[1-[5-(2,3-difluorophenyl)-4-methyl-6-oxo-1-(phenylmethyl)-2-pyrimidinyl]-2-methylpropyl]-4-methylbenzamide IUPAC Name: N-(3-aminopropyl)-N-[1-[1-benzyl-5-(2,3-difluorophenyl)-4-methyl-6-oxopyrimidin-2-yl]-2-methylpropyl]-4-methylbenzamide Traditional Name: N-(3-aminopropyl)-N-[1-[1-benzyl-5-(2,3-difluorophenyl)-6-keto-4-methyl-pyrimidin-2-yl]-2-methyl-propyl]-4-methyl-benzamide Formula: C33H36F2N4O2 MolecularWeight: 558.661346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=NC(=C(C(=O)N2CC3=CC=CC=C3)C4=C(C(=CC=C4)F)F)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=NC(=C(C(=O)N2CC3=CC=CC=C3)C4=C(C(=CC=C4)F)F)C)C(C)C

InChI

InChI=1S/C33H36F2N4O2/c1-21(2)30(38(19-9-18-36)32(40)25-16-14-22(3)15-17-25)31-37-23(4)28(26-12-8-13-27(34)29(26)35)33(41)39(31)20-24-10-6-5-7-11-24/h5-8,10-17,21,30H,9,18-20,36H2,1-4H3