1-[[5-(diethylsulfamoyl)pyridin-2-yl]amino]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[[5-(diethylsulfamoyl)pyridin-2-yl]amino]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[[5-(diethylsulfamoyl)-2-pyridyl]amino]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[[5-(diethylsulfamoyl)-2-pyridinyl]amino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[[5-(diethylsulfamoyl)pyridin-2-yl]amino]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[[5-(diethylsulfamoyl)-2-pyridyl]amino]-3-(4-fluorobenzyl)thiourea Formula: C17H22FN5O2S2 MolecularWeight: 411.517283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)NNC(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)NNC(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C17H22FN5O2S2/c1-3-23(4-2)27(24,25)15-9-10-16(19-12-15)21-22-17(26)20-11-13-5-7-14(18)8-6-13/h5-10,12H,3-4,11H2,1-2H3,(H,19,21)(H2,20,22,26)