1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-[(4-methylphenyl)methyl]thiourea

Systemtic Name: 1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-[(4-methylphenyl)methyl]thiourea Openeye Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(p-tolylmethyl)thiourea CAS Name: 1-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-3-[(4-methylphenyl)methyl]thiourea IUPAC Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-[(4-methylphenyl)methyl]thiourea Traditional Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(4-methylbenzyl)thiourea Formula: C19H19BrN4S MolecularWeight: 415.34996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

InChI

InChI=1S/C19H19BrN4S/c1-14-5-7-15(8-6-14)10-21-19(25)23-18-4-2-3-16(9-18)12-24-13-17(20)11-22-24/h2-9,11,13H,10,12H2,1H3,(H2,21,23,25)