1-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-3-(4-isopropylphenyl)thiourea CAS Name: 1-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[1-(4-bromobenzyl)pyrazol-4-yl]-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=CN(N=C2)CC3=CC=C(C=C3)Br

Isomeric SMILES

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

InChI

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