2-[(4-fluorophenyl)-methylsulfonyl-amino]-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 2-[(4-fluorophenyl)-methylsulfonyl-amino]-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 2-(4-fluoro-N-methylsulfonyl-anilino)-N-[[4-(1-piperidylmethyl)phenyl]methyl]propanamide CAS Name: 2-(4-fluoro-N-methylsulfonylanilino)-N-[[4-(1-piperidinylmethyl)phenyl]methyl]propanamide IUPAC Name: 2-(4-fluoro-N-methylsulfonylanilino)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 2-(4-fluoro-N-mesyl-anilino)-N-[4-(piperidinomethyl)benzyl]propionamide Formula: C23H30FN3O3S MolecularWeight: 447.566003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)CN2CCCCC2)N(C3=CC=C(C=C3)F)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)CN2CCCCC2)N(C3=CC=C(C=C3)F)S(=O)(=O)C

InChI

InChI=1S/C23H30FN3O3S/c1-18(27(31(2,29)30)22-12-10-21(24)11-13-22)23(28)25-16-19-6-8-20(9-7-19)17-26-14-4-3-5-15-26/h6-13,18H,3-5,14-17H2,1-2H3,(H,25,28)