1-(2-azanylethyl)-3-[2,6-bis(fluoranyl)phenyl]thiourea

Systemtic Name: 1-(2-azanylethyl)-3-[2,6-bis(fluoranyl)phenyl]thiourea Openeye Name: 1-(2-aminoethyl)-3-(2,6-difluorophenyl)thiourea CAS Name: 1-(2-aminoethyl)-3-(2,6-difluorophenyl)thiourea IUPAC Name: 1-(2-aminoethyl)-3-(2,6-difluorophenyl)thiourea Traditional Name: 1-(2-aminoethyl)-3-(2,6-difluorophenyl)thiourea Formula: C9H11F2N3S MolecularWeight: 231.265546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)NC(=S)NCCN)F

Isomeric SMILES

C1=CC(=C(C(=C1)F)NC(=S)NCCN)F

InChI

InChI=1S/C9H11F2N3S/c10-6-2-1-3-7(11)8(6)14-9(15)13-5-4-12/h1-3H,4-5,12H2,(H2,13,14,15)