1-[3-(4-bromanylpyrazol-1-yl)propyl]-3-(5-chloranyl-2-methyl-phenyl)thiourea

Systemtic Name: 1-[3-(4-bromanylpyrazol-1-yl)propyl]-3-(5-chloranyl-2-methyl-phenyl)thiourea Openeye Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-(5-chloro-2-methyl-phenyl)thiourea CAS Name: 1-[3-(4-bromo-1-pyrazolyl)propyl]-3-(5-chloro-2-methylphenyl)thiourea IUPAC Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-(5-chloro-2-methylphenyl)thiourea Traditional Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-(5-chloro-2-methyl-phenyl)thiourea Formula: C14H16BrClN4S MolecularWeight: 387.72564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=S)NCCCN2C=C(C=N2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=S)NCCCN2C=C(C=N2)Br

InChI

InChI=1S/C14H16BrClN4S/c1-10-3-4-12(16)7-13(10)19-14(21)17-5-2-6-20-9-11(15)8-18-20/h3-4,7-9H,2,5-6H2,1H3,(H2,17,19,21)