5-[3-bromanyl-2-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]-3-methyl-2-propyl-pyrimidin-4-one

Systemtic Name: 5-[3-bromanyl-2-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]-3-methyl-2-propyl-pyrimidin-4-one Openeye Name: 5-[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]-3-methyl-2-propyl-pyrimidin-4-one CAS Name: 5-[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]-5-benzofuranyl]-3-methyl-2-propyl-4-pyrimidinone IUPAC Name: 5-[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]-3-methyl-2-propylpyrimidin-4-one Traditional Name: 5-[3-bromo-2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]-3-methyl-2-propyl-pyrimidin-4-one Formula: C23H19BrN6O2 MolecularWeight: 491.33996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=C(C(=O)N1C)C2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C5=NNN=N5

Isomeric SMILES

CCCC1=NC=C(C(=O)N1C)C2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C5=NNN=N5

InChI

InChI=1S/C23H19BrN6O2/c1-3-6-19-25-12-17(23(31)30(19)2)13-9-10-18-16(11-13)20(24)21(32-18)14-7-4-5-8-15(14)22-26-28-29-27-22/h4-5,7-12H,3,6H2,1-2H3,(H,26,27,28,29)