2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(4-nitrophenyl)phenyl]ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(4-nitrophenyl)phenyl]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(4-nitrophenyl)phenyl]acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[4-(4-nitrophenyl)phenyl]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(4-nitrophenyl)phenyl]acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[4-(4-nitrophenyl)phenyl]acetamide Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(=O)NC3=CC=C(C=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC(=O)NC3=CC=C(C=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O4S/c25-20(13-29-21-23-18-3-1-2-4-19(18)28-21)22-16-9-5-14(6-10-16)15-7-11-17(12-8-15)24(26)27/h1-12H,13H2,(H,22,25)