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

Systemtic Name: 1-[(4-bromanyl-1,5-dimethyl-pyrazol-3-yl)carbonylamino]-3-butyl-thiourea Openeye Name: 1-[(4-bromo-1,5-dimethyl-pyrazole-3-carbonyl)amino]-3-butyl-thiourea CAS Name: 1-[[(4-bromo-1,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-3-butylthiourea IUPAC Name: 1-[(4-bromo-1,5-dimethylpyrazole-3-carbonyl)amino]-3-butylthiourea Traditional Name: 1-[(4-bromo-1,5-dimethyl-pyrazole-3-carbonyl)amino]-3-butyl-thiourea Formula: C11H18BrN5OS MolecularWeight: 348.26252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=O)C1=NN(C(=C1Br)C)C

Isomeric SMILES

CCCCNC(=S)NNC(=O)C1=NN(C(=C1Br)C)C

InChI

InChI=1S/C11H18BrN5OS/c1-4-5-6-13-11(19)15-14-10(18)9-8(12)7(2)17(3)16-9/h4-6H2,1-3H3,(H,14,18)(H2,13,15,19)