1-(4-bromanyl-2-chloranyl-phenyl)-3-(1H-pyrazol-5-ylmethyl)thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-(1H-pyrazol-5-ylmethyl)thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-(1H-pyrazol-5-ylmethyl)thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-(1H-pyrazol-5-ylmethyl)thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-(1H-pyrazol-5-ylmethyl)thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-(1H-pyrazol-5-ylmethyl)thiourea Formula: C11H10BrClN4S MolecularWeight: 345.6459

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)NC(=S)NCC2=CC=NN2

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)NC(=S)NCC2=CC=NN2

InChI

InChI=1S/C11H10BrClN4S/c12-7-1-2-10(9(13)5-7)16-11(18)14-6-8-3-4-15-17-8/h1-5H,6H2,(H,15,17)(H2,14,16,18)