7-fluoranyl-2-methyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]quinoline-3-carboxamide

Systemtic Name: 7-fluoranyl-2-methyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]quinoline-3-carboxamide Openeye Name: 7-fluoro-2-methyl-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]quinoline-3-carboxamide CAS Name: 7-fluoro-2-methyl-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]-3-quinolinecarboxamide IUPAC Name: 7-fluoro-2-methyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]quinoline-3-carboxamide Traditional Name: 7-fluoro-2-methyl-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]quinoline-3-carboxamide Formula: C20H20FN3O3S2 MolecularWeight: 433.519503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H20FN3O3S2/c1-13-17(10-14-4-5-15(21)11-18(14)23-13)20(25)22-12-16-6-7-19(28-16)29(26,27)24-8-2-3-9-24/h4-7,10-11H,2-3,8-9,12H2,1H3,(H,22,25)