2-[5-azanyl-3-methylsulfanyl-4-(phenylsulfonyl)pyrazol-1-yl]-N-(3-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[5-azanyl-3-methylsulfanyl-4-(phenylsulfonyl)pyrazol-1-yl]-N-(3-methylsulfanylphenyl)ethanamide Openeye Name: 2-[5-amino-4-(benzenesulfonyl)-3-methylsulfanyl-pyrazol-1-yl]-N-(3-methylsulfanylphenyl)acetamide CAS Name: 2-[5-amino-4-(benzenesulfonyl)-3-(methylthio)-1-pyrazolyl]-N-[3-(methylthio)phenyl]acetamide IUPAC Name: 2-[5-amino-4-(benzenesulfonyl)-3-methylsulfanylpyrazol-1-yl]-N-(3-methylsulfanylphenyl)acetamide Traditional Name: 2-[5-amino-4-besyl-3-(methylthio)pyrazol-1-yl]-N-[3-(methylthio)phenyl]acetamide Formula: C19H20N4O3S3 MolecularWeight: 448.5821

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CN2C(=C(C(=N2)SC)S(=O)(=O)C3=CC=CC=C3)N

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CN2C(=C(C(=N2)SC)S(=O)(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C19H20N4O3S3/c1-27-14-8-6-7-13(11-14)21-16(24)12-23-18(20)17(19(22-23)28-2)29(25,26)15-9-4-3-5-10-15/h3-11H,12,20H2,1-2H3,(H,21,24)