N-(2-azanylethyl)-4-bromanyl-N-[1-[6-oxidanylidene-5-phenyl-1-(phenylmethyl)pyrimidin-2-yl]propyl]benzamide

Systemtic Name: N-(2-azanylethyl)-4-bromanyl-N-[1-[6-oxidanylidene-5-phenyl-1-(phenylmethyl)pyrimidin-2-yl]propyl]benzamide Openeye Name: N-(2-aminoethyl)-N-[1-(1-benzyl-6-oxo-5-phenyl-pyrimidin-2-yl)propyl]-4-bromo-benzamide CAS Name: N-(2-aminoethyl)-4-bromo-N-[1-[6-oxo-5-phenyl-1-(phenylmethyl)-2-pyrimidinyl]propyl]benzamide IUPAC Name: N-(2-aminoethyl)-N-[1-(1-benzyl-6-oxo-5-phenylpyrimidin-2-yl)propyl]-4-bromobenzamide Traditional Name: N-(2-aminoethyl)-N-[1-(1-benzyl-6-keto-5-phenyl-pyrimidin-2-yl)propyl]-4-bromo-benzamide Formula: C29H29BrN4O2 MolecularWeight: 545.47016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC=C(C(=O)N1CC2=CC=CC=C2)C3=CC=CC=C3)N(CCN)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC(C1=NC=C(C(=O)N1CC2=CC=CC=C2)C3=CC=CC=C3)N(CCN)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C29H29BrN4O2/c1-2-26(33(18-17-31)28(35)23-13-15-24(30)16-14-23)27-32-19-25(22-11-7-4-8-12-22)29(36)34(27)20-21-9-5-3-6-10-21/h3-16,19,26H,2,17-18,20,31H2,1H3