2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(4-morpholin-4-ylphenyl)benzamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(4-morpholin-4-ylphenyl)benzamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(4-morpholinophenyl)benzamide CAS Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-[4-(4-morpholinyl)phenyl]benzamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-(4-morpholin-4-ylphenyl)benzamide Traditional Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-(4-morpholinophenyl)benzamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C25H23N3O3S/c29-24(26-19-9-11-20(12-10-19)28-13-15-30-16-14-28)21-6-2-1-5-18(21)17-32-25-27-22-7-3-4-8-23(22)31-25/h1-12H,13-17H2,(H,26,29)