2-[2-(4-butan-2-ylphenyl)-2-oxidanylidene-ethyl]sulfanyl-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 2-[2-(4-butan-2-ylphenyl)-2-oxidanylidene-ethyl]sulfanyl-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Openeye Name: N,N-dimethyl-2-[2-oxo-2-(4-sec-butylphenyl)ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide CAS Name: 2-[[2-(4-butan-2-ylphenyl)-2-oxoethyl]thio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[2-(4-butan-2-ylphenyl)-2-oxoethyl]sulfanyl-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[[2-keto-2-(4-sec-butylphenyl)ethyl]thio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(=O)CSC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(=O)CSC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H24N2O4S2/c1-5-14(2)15-6-8-16(9-7-15)19(24)13-28-21-22-18-12-17(10-11-20(18)27-21)29(25,26)23(3)4/h6-12,14H,5,13H2,1-4H3