3-[[5-(3-fluoranyl-4-methylsulfonyl-phenyl)-4-methyl-1,3-thiazol-2-yl]carbamoylamino]-2,2-dimethyl-propanamide

Systemtic Name: 3-[[5-(3-fluoranyl-4-methylsulfonyl-phenyl)-4-methyl-1,3-thiazol-2-yl]carbamoylamino]-2,2-dimethyl-propanamide Openeye Name: 3-[[5-(3-fluoro-4-methylsulfonyl-phenyl)-4-methyl-thiazol-2-yl]carbamoylamino]-2,2-dimethyl-propanamide CAS Name: 3-[[[[5-(3-fluoro-4-methylsulfonylphenyl)-4-methyl-2-thiazolyl]amino]-oxomethyl]amino]-2,2-dimethylpropanamide IUPAC Name: 3-[[5-(3-fluoro-4-methylsulfonylphenyl)-4-methyl-1,3-thiazol-2-yl]carbamoylamino]-2,2-dimethylpropanamide Traditional Name: 3-[[5-(3-fluoro-4-mesyl-phenyl)-4-methyl-thiazol-2-yl]carbamoylamino]-2,2-dimethyl-propionamide Formula: C17H21FN4O4S2 MolecularWeight: 428.501443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)NCC(C)(C)C(=O)N)C2=CC(=C(C=C2)S(=O)(=O)C)F

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)NCC(C)(C)C(=O)N)C2=CC(=C(C=C2)S(=O)(=O)C)F

InChI

InChI=1S/C17H21FN4O4S2/c1-9-13(10-5-6-12(11(18)7-10)28(4,25)26)27-16(21-9)22-15(24)20-8-17(2,3)14(19)23/h5-7H,8H2,1-4H3,(H2,19,23)(H2,20,21,22,24)