N-(4-chlorophenyl)-2-[4-(3-phenyl-1,2-oxazol-5-yl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-chlorophenyl)-2-[4-(3-phenyl-1,2-oxazol-5-yl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-chlorophenyl)-2-[4-(3-phenylisoxazol-5-yl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(4-chlorophenyl)-2-[[4-(3-phenyl-5-isoxazolyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(4-chlorophenyl)-2-[4-(3-phenyl-1,2-oxazol-5-yl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(4-chlorophenyl)-2-[[4-(3-phenylisoxazol-5-yl)pyrimidin-2-yl]thio]acetamide Formula: C21H15ClN4O2S MolecularWeight: 422.8874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NOC(=C2)C3=NC(=NC=C3)SCC(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NOC(=C2)C3=NC(=NC=C3)SCC(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN4O2S/c22-15-6-8-16(9-7-15)24-20(27)13-29-21-23-11-10-17(25-21)19-12-18(26-28-19)14-4-2-1-3-5-14/h1-12H,13H2,(H,24,27)