2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-N'-(4-methoxyphenyl)sulfonyl-propanimidamide

Systemtic Name: 2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-N'-(4-methoxyphenyl)sulfonyl-propanimidamide Openeye Name: 2-[4-(4-fluorobenzoyl)-1-piperidyl]-N'-(4-methoxyphenyl)sulfonyl-propanamidine CAS Name: 2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]-N'-(4-methoxyphenyl)sulfonylpropanimidamide IUPAC Name: 2-[4-(4-fluorobenzoyl)piperidin-1-yl]-N'-(4-methoxyphenyl)sulfonylpropanimidamide Traditional Name: 2-[4-(4-fluorobenzoyl)piperidino]-N'-(4-methoxyphenyl)sulfonyl-propionamidine Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=NS(=O)(=O)C1=CC=C(C=C1)OC)N)N2CCC(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(/C(=N/S(=O)(=O)C1=CC=C(C=C1)OC)/N)N2CCC(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O4S/c1-15(22(24)25-31(28,29)20-9-7-19(30-2)8-10-20)26-13-11-17(12-14-26)21(27)16-3-5-18(23)6-4-16/h3-10,15,17H,11-14H2,1-2H3,(H2,24,25)