1-(4-bromanyl-2-chloranyl-phenyl)-3-[3-(4-chloranylpyrazol-1-yl)propyl]thiourea

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[3-(4-chloranylpyrazol-1-yl)propyl]thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-[3-(4-chloropyrazol-1-yl)propyl]thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[3-(4-chloro-1-pyrazolyl)propyl]thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-[3-(4-chloropyrazol-1-yl)propyl]thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-[3-(4-chloropyrazol-1-yl)propyl]thiourea Formula: C13H13BrCl2N4S MolecularWeight: 408.14412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)NC(=S)NCCCN2C=C(C=N2)Cl

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)NC(=S)NCCCN2C=C(C=N2)Cl

InChI

InChI=1S/C13H13BrCl2N4S/c14-9-2-3-12(11(16)6-9)19-13(21)17-4-1-5-20-8-10(15)7-18-20/h2-3,6-8H,1,4-5H2,(H2,17,19,21)