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

Systemtic Name: N-(4-chloranyl-3-methyl-1,2-oxazol-5-yl)-2-[(4-dimethylaminophenyl)methyl]-1-benzothiophene-3-sulfonamide Openeye Name: N-(4-chloro-3-methyl-isoxazol-5-yl)-2-[(4-dimethylaminophenyl)methyl]benzothiophene-3-sulfonamide CAS Name: N-(4-chloro-3-methyl-5-isoxazolyl)-2-[(4-dimethylaminophenyl)methyl]-1-benzothiophene-3-sulfonamide IUPAC Name: N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-2-[(4-dimethylaminophenyl)methyl]-1-benzothiophene-3-sulfonamide Traditional Name: N-(4-chloro-3-methyl-isoxazol-5-yl)-2-[4-(dimethylamino)benzyl]benzothiophene-3-sulfonamide Formula: C21H20ClN3O3S2 MolecularWeight: 461.9848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1Cl)NS(=O)(=O)C2=C(SC3=CC=CC=C32)CC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=NOC(=C1Cl)NS(=O)(=O)C2=C(SC3=CC=CC=C32)CC4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C21H20ClN3O3S2/c1-13-19(22)21(28-23-13)24-30(26,27)20-16-6-4-5-7-17(16)29-18(20)12-14-8-10-15(11-9-14)25(2)3/h4-11,24H,12H2,1-3H3