1-(4-bromanyl-2-chloranyl-phenyl)-3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-[(1-ethyl-5-methylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]thiourea Formula: C14H16BrClN4S MolecularWeight: 387.72564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16BrClN4S/c1-3-20-9(2)10(8-18-20)7-17-14(21)19-13-5-4-11(15)6-12(13)16/h4-6,8H,3,7H2,1-2H3,(H2,17,19,21)