1-(4-bromanyl-2-chloranyl-phenyl)-3-[(1-ethylpyrazol-3-yl)methyl]thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[(1-ethylpyrazol-3-yl)methyl]thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-[(1-ethylpyrazol-3-yl)methyl]thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[(1-ethyl-3-pyrazolyl)methyl]thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-[(1-ethylpyrazol-3-yl)methyl]thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-[(1-ethylpyrazol-3-yl)methyl]thiourea Formula: C13H14BrClN4S MolecularWeight: 373.69906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)CNC(=S)NC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CCN1C=CC(=N1)CNC(=S)NC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C13H14BrClN4S/c1-2-19-6-5-10(18-19)8-16-13(20)17-12-4-3-9(14)7-11(12)15/h3-7H,2,8H2,1H3,(H2,16,17,20)