N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-4-fluoranyl-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-4-fluoranyl-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-4-fluoro-3-morpholinosulfonyl-benzamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-4-fluoro-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-4-fluoro-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-4-fluoro-3-morpholinosulfonyl-benzamide Formula: C18H18FN3O4S2 MolecularWeight: 423.481623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C18H18FN3O4S2/c1-11-12(2)27-18(14(11)10-20)21-17(23)13-3-4-15(19)16(9-13)28(24,25)22-5-7-26-8-6-22/h3-4,9H,5-8H2,1-2H3,(H,21,23)