5-methylsulfanyl-4-[3-(3-propan-2-ylphenyl)phenyl]sulfonyl-thiophene-2-carboximidamide

Systemtic Name: 5-methylsulfanyl-4-[3-(3-propan-2-ylphenyl)phenyl]sulfonyl-thiophene-2-carboximidamide Openeye Name: 4-[3-(3-isopropylphenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 5-(methylthio)-4-[3-(3-propan-2-ylphenyl)phenyl]sulfonyl-2-thiophenecarboximidamide IUPAC Name: 5-methylsulfanyl-4-[3-(3-propan-2-ylphenyl)phenyl]sulfonylthiophene-2-carboximidamide Traditional Name: 4-(3-m-cumenylphenyl)sulfonyl-5-(methylthio)thiophene-2-carboxamidine Formula: C21H22N2O2S3 MolecularWeight: 430.60658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O2S3/c1-13(2)14-6-4-7-15(10-14)16-8-5-9-17(11-16)28(24,25)19-12-18(20(22)23)27-21(19)26-3/h4-13H,1-3H3,(H3,22,23)