1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(4-isopropylphenyl)thiourea CAS Name: 1-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-p-cumenyl-thiourea Formula: C20H21BrN4S MolecularWeight: 429.37654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21BrN4S/c1-14(2)16-6-8-18(9-7-16)23-20(26)24-19-5-3-4-15(10-19)12-25-13-17(21)11-22-25/h3-11,13-14H,12H2,1-2H3,(H2,23,24,26)