1-[(5-bromanylthiophen-2-yl)methyl]-1-methyl-3-[(1-phenylpyrazol-4-yl)methyl]urea

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)methyl]-1-methyl-3-[(1-phenylpyrazol-4-yl)methyl]urea Openeye Name: 1-[(5-bromo-2-thienyl)methyl]-1-methyl-3-[(1-phenylpyrazol-4-yl)methyl]urea CAS Name: 1-[(5-bromo-2-thiophenyl)methyl]-1-methyl-3-[(1-phenyl-4-pyrazolyl)methyl]urea IUPAC Name: 1-[(5-bromothiophen-2-yl)methyl]-1-methyl-3-[(1-phenylpyrazol-4-yl)methyl]urea Traditional Name: 1-[(5-bromo-2-thienyl)methyl]-1-methyl-3-[(1-phenylpyrazol-4-yl)methyl]urea Formula: C17H17BrN4OS MolecularWeight: 405.31208

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Br)C(=O)NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=C(S1)Br)C(=O)NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H17BrN4OS/c1-21(12-15-7-8-16(18)24-15)17(23)19-9-13-10-20-22(11-13)14-5-3-2-4-6-14/h2-8,10-11H,9,12H2,1H3,(H,19,23)