1-[5-azanyl-1-(2-chlorophenyl)-3-phenyl-pyrazol-4-yl]-3-butan-2-yl-urea

Systemtic Name: 1-[5-azanyl-1-(2-chlorophenyl)-3-phenyl-pyrazol-4-yl]-3-butan-2-yl-urea Openeye Name: 1-[5-amino-1-(2-chlorophenyl)-3-phenyl-pyrazol-4-yl]-3-sec-butyl-urea CAS Name: 1-[5-amino-1-(2-chlorophenyl)-3-phenyl-4-pyrazolyl]-3-butan-2-ylurea IUPAC Name: 1-[5-amino-1-(2-chlorophenyl)-3-phenylpyrazol-4-yl]-3-butan-2-ylurea Traditional Name: 1-[5-amino-1-(2-chlorophenyl)-3-phenyl-pyrazol-4-yl]-3-sec-butyl-urea Formula: C20H22ClN5O MolecularWeight: 383.87458

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC1=C(N(N=C1C2=CC=CC=C2)C3=CC=CC=C3Cl)N

Isomeric SMILES

CCC(C)NC(=O)NC1=C(N(N=C1C2=CC=CC=C2)C3=CC=CC=C3Cl)N

InChI

InChI=1S/C20H22ClN5O/c1-3-13(2)23-20(27)24-18-17(14-9-5-4-6-10-14)25-26(19(18)22)16-12-8-7-11-15(16)21/h4-13H,3,22H2,1-2H3,(H2,23,24,27)