methanesulfonyl chloride; N-[4-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)phenyl]methanesulfonamide

Systemtic Name: methanesulfonyl chloride; N-[4-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)phenyl]methanesulfonamide Openeye Name: methanesulfonyl chloride; N-[4-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenyl]methanesulfonamide CAS Name: methanesulfonyl chloride; N-[4-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenyl]methanesulfonamide IUPAC Name: methanesulfonyl chloride; N-[4-(3-methyl-5-oxo-4H-pyrazol-1-yl)phenyl]methanesulfonamide Traditional Name: N-[4-(5-keto-3-methyl-2-pyrazolin-1-yl)phenyl]methanesulfonamide; methanesulfonyl chloride Formula: C12H16ClN3O5S2 MolecularWeight: 381.85554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C2=CC=C(C=C2)NS(=O)(=O)C.CS(=O)(=O)Cl

Isomeric SMILES

CC1=NN(C(=O)C1)C2=CC=C(C=C2)NS(=O)(=O)C.CS(=O)(=O)Cl

InChI

InChI=1S/C11H13N3O3S.CH3ClO2S/c1-8-7-11(15)14(12-8)10-5-3-9(4-6-10)13-18(2,16)17;1-5(2,3)4/h3-6,13H,7H2,1-2H3;1H3