1-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-butyl-thiourea

Systemtic Name: 1-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-butyl-thiourea Openeye Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-butyl-thiourea CAS Name: 1-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-3-butylthiourea IUPAC Name: 1-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-3-butylthiourea Traditional Name: 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-butyl-thiourea Formula: C13H23BrN4S MolecularWeight: 347.31752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NCCCN1C(=C(C(=N1)C)Br)C

Isomeric SMILES

CCCCNC(=S)NCCCN1C(=C(C(=N1)C)Br)C

InChI

InChI=1S/C13H23BrN4S/c1-4-5-7-15-13(19)16-8-6-9-18-11(3)12(14)10(2)17-18/h4-9H2,1-3H3,(H2,15,16,19)