N-(4-chlorophenyl)-2-(2-oxidanylidenepropylsulfanyl)-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N-(4-chlorophenyl)-2-(2-oxidanylidenepropylsulfanyl)-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-acetonylsulfanyl-N-(4-chlorophenyl)-1,3-benzoxazole-5-sulfonamide CAS Name: N-(4-chlorophenyl)-2-(2-oxopropylthio)-1,3-benzoxazole-5-sulfonamide IUPAC Name: N-(4-chlorophenyl)-2-(2-oxopropylsulfanyl)-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-(acetonylthio)-N-(4-chlorophenyl)-1,3-benzoxazole-5-sulfonamide Formula: C16H13ClN2O4S2 MolecularWeight: 396.86842

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)CSC1=NC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2O4S2/c1-10(20)9-24-16-18-14-8-13(6-7-15(14)23-16)25(21,22)19-12-4-2-11(17)3-5-12/h2-8,19H,9H2,1H3