2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloranyl-4-methoxy-phenyl)-2-phenyl-ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloranyl-4-methoxy-phenyl)-2-phenyl-ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloro-4-methoxy-phenyl)-2-phenyl-acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(3-chloro-4-methoxyphenyl)-2-phenylacetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-chloro-4-methoxyphenyl)-2-phenylacetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(3-chloro-4-methoxy-phenyl)-2-phenyl-acetamide Formula: C22H17ClN2O3S MolecularWeight: 424.89998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4O3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4O3)Cl

InChI

InChI=1S/C22H17ClN2O3S/c1-27-18-12-11-15(13-16(18)23)24-21(26)20(14-7-3-2-4-8-14)29-22-25-17-9-5-6-10-19(17)28-22/h2-13,20H,1H3,(H,24,26)