1,3-bis[(1-phenylpyrazol-4-yl)methyl]urea

Systemtic Name: 1,3-bis[(1-phenylpyrazol-4-yl)methyl]urea Openeye Name: 1,3-bis[(1-phenylpyrazol-4-yl)methyl]urea CAS Name: 1,3-bis[(1-phenyl-4-pyrazolyl)methyl]urea IUPAC Name: 1,3-bis[(1-phenylpyrazol-4-yl)methyl]urea Traditional Name: 1,3-bis[(1-phenylpyrazol-4-yl)methyl]urea Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)NCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)NCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N6O/c28-21(22-11-17-13-24-26(15-17)19-7-3-1-4-8-19)23-12-18-14-25-27(16-18)20-9-5-2-6-10-20/h1-10,13-16H,11-12H2,(H2,22,23,28)