1-(2-ethylphenyl)-3-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]urea

Systemtic Name: 1-(2-ethylphenyl)-3-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]urea Openeye Name: 1-(2-ethylphenyl)-3-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]urea CAS Name: 1-(2-ethylphenyl)-3-[[3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]urea IUPAC Name: 1-(2-ethylphenyl)-3-[(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methyl]urea Traditional Name: 1-(2-ethylphenyl)-3-[(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]urea Formula: C24H25N5O MolecularWeight: 399.4882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)NCC2=C(N(N=C2C)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)NCC2=C(N(N=C2C)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C24H25N5O/c1-3-19-11-7-8-14-22(19)26-24(30)25-17-21-18(2)27-29(20-12-5-4-6-13-20)23(21)28-15-9-10-16-28/h4-16H,3,17H2,1-2H3,(H2,25,26,30)