1-[3-(4-bromanylpyrazol-1-yl)propyl]-3-(4-bromophenyl)thiourea

Systemtic Name: 1-[3-(4-bromanylpyrazol-1-yl)propyl]-3-(4-bromophenyl)thiourea Openeye Name: 1-(4-bromophenyl)-3-[3-(4-bromopyrazol-1-yl)propyl]thiourea CAS Name: 1-(4-bromophenyl)-3-[3-(4-bromo-1-pyrazolyl)propyl]thiourea IUPAC Name: 1-(4-bromophenyl)-3-[3-(4-bromopyrazol-1-yl)propyl]thiourea Traditional Name: 1-(4-bromophenyl)-3-[3-(4-bromopyrazol-1-yl)propyl]thiourea Formula: C13H14Br2N4S MolecularWeight: 418.15006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NCCCN2C=C(C=N2)Br)Br

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NCCCN2C=C(C=N2)Br)Br

InChI

InChI=1S/C13H14Br2N4S/c14-10-2-4-12(5-3-10)18-13(20)16-6-1-7-19-9-11(15)8-17-19/h2-5,8-9H,1,6-7H2,(H2,16,18,20)