1-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-3-(4-ethanoylphenyl)thiourea

Systemtic Name: 1-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-3-(4-ethanoylphenyl)thiourea Openeye Name: 1-(4-acetylphenyl)-3-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]thiourea CAS Name: 1-(4-acetylphenyl)-3-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-(4-acetylphenyl)-3-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-(4-acetylphenyl)-3-[1-(4-bromobenzyl)pyrazol-4-yl]thiourea Formula: C19H17BrN4OS MolecularWeight: 429.33348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=CN(N=C2)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=CN(N=C2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN4OS/c1-13(25)15-4-8-17(9-5-15)22-19(26)23-18-10-21-24(12-18)11-14-2-6-16(20)7-3-14/h2-10,12H,11H2,1H3,(H2,22,23,26)