N-(4-butylphenyl)-3-(4-chlorophenyl)-2-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: N-(4-butylphenyl)-3-(4-chlorophenyl)-2-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: N-(4-butylphenyl)-3-(4-chlorophenyl)-2-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: N-(4-butylphenyl)-3-(4-chlorophenyl)-2-methyl-5-phenyl-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: N-(4-butylphenyl)-3-(4-chlorophenyl)-2-methyl-5-phenylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (4-butylphenyl)-[3-(4-chlorophenyl)-2-methyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl]amine Formula: C29H27ClN4 MolecularWeight: 467.00448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=CC(=NC3=C(C(=NN23)C)C4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=CC(=NC3=C(C(=NN23)C)C4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C29H27ClN4/c1-3-4-8-21-11-17-25(18-12-21)31-27-19-26(22-9-6-5-7-10-22)32-29-28(20(2)33-34(27)29)23-13-15-24(30)16-14-23/h5-7,9-19,31H,3-4,8H2,1-2H3