1-[4-[bis(fluoranyl)methoxy]phenyl]-3-(3-methylbutanoylamino)thiourea

Systemtic Name: 1-[4-[bis(fluoranyl)methoxy]phenyl]-3-(3-methylbutanoylamino)thiourea Openeye Name: 1-[4-(difluoromethoxy)phenyl]-3-(3-methylbutanoylamino)thiourea CAS Name: 1-[4-(difluoromethoxy)phenyl]-3-[(3-methyl-1-oxobutyl)amino]thiourea IUPAC Name: 1-[4-(difluoromethoxy)phenyl]-3-(3-methylbutanoylamino)thiourea Traditional Name: 1-[4-(difluoromethoxy)phenyl]-3-(isovalerylamino)thiourea Formula: C13H17F2N3O2S MolecularWeight: 317.354786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=S)NC1=CC=C(C=C1)OC(F)F

Isomeric SMILES

CC(C)CC(=O)NNC(=S)NC1=CC=C(C=C1)OC(F)F

InChI

InChI=1S/C13H17F2N3O2S/c1-8(2)7-11(19)17-18-13(21)16-9-3-5-10(6-4-9)20-12(14)15/h3-6,8,12H,7H2,1-2H3,(H,17,19)(H2,16,18,21)