[4-azanyl-2-[(1-methylsulfonylpiperidin-4-yl)amino]-1,3-thiazol-5-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone

Systemtic Name: [4-azanyl-2-[(1-methylsulfonylpiperidin-4-yl)amino]-1,3-thiazol-5-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone Openeye Name: [4-amino-2-[(1-methylsulfonyl-4-piperidyl)amino]thiazol-5-yl]-(3-fluoro-4-methoxy-phenyl)methanone CAS Name: [4-amino-2-[(1-methylsulfonyl-4-piperidinyl)amino]-5-thiazolyl]-(3-fluoro-4-methoxyphenyl)methanone IUPAC Name: [4-amino-2-[(1-methylsulfonylpiperidin-4-yl)amino]-1,3-thiazol-5-yl]-(3-fluoro-4-methoxyphenyl)methanone Traditional Name: [4-amino-2-[(1-mesyl-4-piperidyl)amino]thiazol-5-yl]-(3-fluoro-4-methoxy-phenyl)methanone Formula: C17H21FN4O4S2 MolecularWeight: 428.501443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2=C(N=C(S2)NC3CCN(CC3)S(=O)(=O)C)N)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C2=C(N=C(S2)NC3CCN(CC3)S(=O)(=O)C)N)F

InChI

InChI=1S/C17H21FN4O4S2/c1-26-13-4-3-10(9-12(13)18)14(23)15-16(19)21-17(27-15)20-11-5-7-22(8-6-11)28(2,24)25/h3-4,9,11H,5-8,19H2,1-2H3,(H,20,21)