N-[2-(2-fluorophenyl)ethyl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[2-(2-fluorophenyl)ethyl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-[2-(2-fluorophenyl)ethyl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-[2-(2-fluorophenyl)ethyl]-1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(2-fluorophenyl)ethyl]-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-[2-(2-fluorophenyl)ethyl]-1-(7-mesyl-4-methyl-quinazolin-2-yl)isonipecotamide Formula: C24H27FN4O3S MolecularWeight: 470.559583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)NCCC4=CC=CC=C4F

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)NCCC4=CC=CC=C4F

InChI

InChI=1S/C24H27FN4O3S/c1-16-20-8-7-19(33(2,31)32)15-22(20)28-24(27-16)29-13-10-18(11-14-29)23(30)26-12-9-17-5-3-4-6-21(17)25/h3-8,15,18H,9-14H2,1-2H3,(H,26,30)