N-(4-acetamido-3-chloranyl-phenyl)-2-(1,3-benzoxazol-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-2-(1,3-benzoxazol-2-ylsulfanylmethyl)benzamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-2-(1,3-benzoxazol-2-ylsulfanylmethyl)benzamide CAS Name: N-(4-acetamido-3-chlorophenyl)-2-[(1,3-benzoxazol-2-ylthio)methyl]benzamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-2-(1,3-benzoxazol-2-ylsulfanylmethyl)benzamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-2-[(1,3-benzoxazol-2-ylthio)methyl]benzamide Formula: C23H18ClN3O3S MolecularWeight: 451.92532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4O3)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2CSC3=NC4=CC=CC=C4O3)Cl

InChI

InChI=1S/C23H18ClN3O3S/c1-14(28)25-19-11-10-16(12-18(19)24)26-22(29)17-7-3-2-6-15(17)13-31-23-27-20-8-4-5-9-21(20)30-23/h2-12H,13H2,1H3,(H,25,28)(H,26,29)