1-[[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propanoyl]amino]-3-(2,5-dimethylphenyl)thiourea

Systemtic Name: 1-[[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propanoyl]amino]-3-(2,5-dimethylphenyl)thiourea Openeye Name: 1-[[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propanoyl]amino]-3-(2,5-dimethylphenyl)thiourea CAS Name: 1-[[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-2-methyl-1-oxopropyl]amino]-3-(2,5-dimethylphenyl)thiourea IUPAC Name: 1-[[3-(4-bromo-3,5-dimethylpyrazol-1-yl)-2-methylpropanoyl]amino]-3-(2,5-dimethylphenyl)thiourea Traditional Name: 1-[[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-2-methyl-propanoyl]amino]-3-(2,5-dimethylphenyl)thiourea Formula: C18H24BrN5OS MolecularWeight: 438.38506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NNC(=O)C(C)CN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NNC(=O)C(C)CN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C18H24BrN5OS/c1-10-6-7-11(2)15(8-10)20-18(26)22-21-17(25)12(3)9-24-14(5)16(19)13(4)23-24/h6-8,12H,9H2,1-5H3,(H,21,25)(H2,20,22,26)