2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-N-(4-chloranyl-3-nitro-phenyl)-2-phenyl-ethanamide

Systemtic Name: 2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-N-(4-chloranyl-3-nitro-phenyl)-2-phenyl-ethanamide Openeye Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N-(4-chloro-3-nitro-phenyl)-2-phenyl-acetamide CAS Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)thio]-N-(4-chloro-3-nitrophenyl)-2-phenylacetamide IUPAC Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N-(4-chloro-3-nitrophenyl)-2-phenylacetamide Traditional Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)thio]-N-(4-chloro-3-nitro-phenyl)-2-phenyl-acetamide Formula: C21H13Cl2N3O4S MolecularWeight: 474.31662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])SC3=NC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])SC3=NC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C21H13Cl2N3O4S/c22-13-6-9-18-16(10-13)25-21(30-18)31-19(12-4-2-1-3-5-12)20(27)24-14-7-8-15(23)17(11-14)26(28)29/h1-11,19H,(H,24,27)