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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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