3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1-[2-(3-chloranyl-4-methylsulfonyl-thiophen-2-yl)carbonylpyrazolidin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1-[2-(3-chloranyl-4-methylsulfonyl-thiophen-2-yl)carbonylpyrazolidin-1-yl]prop-2-en-1-one Openeye Name: 3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-[2-(3-chloro-4-methylsulfonyl-thiophene-2-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one CAS Name: 3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-1-[2-[(3-chloro-4-methylsulfonyl-2-thiophenyl)-oxomethyl]-1-pyrazolidinyl]-2-propen-1-one IUPAC Name: 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-[2-(3-chloro-4-methylsulfonylthiophene-2-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one Traditional Name: 3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-[2-(3-chloro-4-mesyl-thiophene-2-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one Formula: C17H18Cl2N4O4S2 MolecularWeight: 477.38522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)N2CCCN2C(=O)C3=C(C(=CS3)S(=O)(=O)C)Cl)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C=CC(=O)N2CCCN2C(=O)C3=C(C(=CS3)S(=O)(=O)C)Cl)Cl)C

InChI

InChI=1S/C17H18Cl2N4O4S2/c1-10-11(16(19)21(2)20-10)5-6-13(24)22-7-4-8-23(22)17(25)15-14(18)12(9-28-15)29(3,26)27/h5-6,9H,4,7-8H2,1-3H3