2-[4-(2-chloranylpyrimidin-4-yl)but-3-ynyl]-1,3-benzoxazole

Systemtic Name: 2-[4-(2-chloranylpyrimidin-4-yl)but-3-ynyl]-1,3-benzoxazole Openeye Name: 2-[4-(2-chloropyrimidin-4-yl)but-3-ynyl]-1,3-benzoxazole CAS Name: 2-[4-(2-chloro-4-pyrimidinyl)but-3-ynyl]-1,3-benzoxazole IUPAC Name: 2-[4-(2-chloropyrimidin-4-yl)but-3-ynyl]-1,3-benzoxazole Traditional Name: 2-[4-(2-chloropyrimidin-4-yl)but-3-ynyl]-1,3-benzoxazole Formula: C15H10ClN3O MolecularWeight: 283.7124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)CCC#CC3=NC(=NC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)CCC#CC3=NC(=NC=C3)Cl

InChI

InChI=1S/C15H10ClN3O/c16-15-17-10-9-11(18-15)5-1-4-8-14-19-12-6-2-3-7-13(12)20-14/h2-3,6-7,9-10H,4,8H2