4-[3-(2,6-dimethylphenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide

Systemtic Name: 4-[3-(2,6-dimethylphenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboximidamide Openeye Name: 4-[3-(2,6-dimethylphenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 4-[3-(2,6-dimethylphenyl)phenyl]sulfonyl-5-(methylthio)-2-thiophenecarboximidamide IUPAC Name: 4-[3-(2,6-dimethylphenyl)phenyl]sulfonyl-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-[3-(2,6-dimethylphenyl)phenyl]sulfonyl-5-(methylthio)thiophene-2-carboxamidine Formula: C20H20N2O2S3 MolecularWeight: 416.58

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2=CC(=CC=C2)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2=CC(=CC=C2)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC

InChI

InChI=1S/C20H20N2O2S3/c1-12-6-4-7-13(2)18(12)14-8-5-9-15(10-14)27(23,24)17-11-16(19(21)22)26-20(17)25-3/h4-11H,1-3H3,(H3,21,22)