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

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[(1-methyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea Formula: C12H12BrClN4S MolecularWeight: 359.67248

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC(=S)NC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CN1C=C(C=N1)CNC(=S)NC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C12H12BrClN4S/c1-18-7-8(6-16-18)5-15-12(19)17-11-3-2-9(13)4-10(11)14/h2-4,6-7H,5H2,1H3,(H2,15,17,19)