N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[(4-fluoro-3-methyl-phenyl)methyl]-3-(1-piperidylsulfonyl)thiophene-2-carboxamide CAS Name: N-[(4-fluoro-3-methylphenyl)methyl]-3-(1-piperidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-[(4-fluoro-3-methylphenyl)methyl]-3-piperidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-(4-fluoro-3-methyl-benzyl)-3-piperidinosulfonyl-thiophene-2-carboxamide Formula: C18H21FN2O3S2 MolecularWeight: 396.499343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3)F

InChI

InChI=1S/C18H21FN2O3S2/c1-13-11-14(5-6-15(13)19)12-20-18(22)17-16(7-10-25-17)26(23,24)21-8-3-2-4-9-21/h5-7,10-11H,2-4,8-9,12H2,1H3,(H,20,22)