N-(2-bromophenyl)-N-[3-(3-methylphenyl)-4-pyrimidin-4-yl-1,2-oxazol-5-yl]ethanamide

Systemtic Name: N-(2-bromophenyl)-N-[3-(3-methylphenyl)-4-pyrimidin-4-yl-1,2-oxazol-5-yl]ethanamide Openeye Name: N-(2-bromophenyl)-N-[3-(m-tolyl)-4-pyrimidin-4-yl-isoxazol-5-yl]acetamide CAS Name: N-(2-bromophenyl)-N-[3-(3-methylphenyl)-4-(4-pyrimidinyl)-5-isoxazolyl]acetamide IUPAC Name: N-(2-bromophenyl)-N-[3-(3-methylphenyl)-4-pyrimidin-4-yl-1,2-oxazol-5-yl]acetamide Traditional Name: N-(2-bromophenyl)-N-[3-(m-tolyl)-4-(4-pyrimidyl)isoxazol-5-yl]acetamide Formula: C22H17BrN4O2 MolecularWeight: 449.29998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=C2C3=NC=NC=C3)N(C4=CC=CC=C4Br)C(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=C2C3=NC=NC=C3)N(C4=CC=CC=C4Br)C(=O)C

InChI

InChI=1S/C22H17BrN4O2/c1-14-6-5-7-16(12-14)21-20(18-10-11-24-13-25-18)22(29-26-21)27(15(2)28)19-9-4-3-8-17(19)23/h3-13H,1-2H3