N-(4-chloranyl-3-methyl-1,2-oxazol-5-yl)-2-[(2,4,6-trimethylphenyl)methyl]-1-benzothiophene-3-sulfonamide

Systemtic Name: N-(4-chloranyl-3-methyl-1,2-oxazol-5-yl)-2-[(2,4,6-trimethylphenyl)methyl]-1-benzothiophene-3-sulfonamide Openeye Name: N-(4-chloro-3-methyl-isoxazol-5-yl)-2-[(2,4,6-trimethylphenyl)methyl]benzothiophene-3-sulfonamide CAS Name: N-(4-chloro-3-methyl-5-isoxazolyl)-2-[(2,4,6-trimethylphenyl)methyl]-1-benzothiophene-3-sulfonamide IUPAC Name: N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-2-[(2,4,6-trimethylphenyl)methyl]-1-benzothiophene-3-sulfonamide Traditional Name: N-(4-chloro-3-methyl-isoxazol-5-yl)-2-(2,4,6-trimethylbenzyl)benzothiophene-3-sulfonamide Formula: C22H21ClN2O3S2 MolecularWeight: 460.99674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CC2=C(C3=CC=CC=C3S2)S(=O)(=O)NC4=C(C(=NO4)C)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CC2=C(C3=CC=CC=C3S2)S(=O)(=O)NC4=C(C(=NO4)C)Cl)C

InChI

InChI=1S/C22H21ClN2O3S2/c1-12-9-13(2)17(14(3)10-12)11-19-21(16-7-5-6-8-18(16)29-19)30(26,27)25-22-20(23)15(4)24-28-22/h5-10,25H,11H2,1-4H3