6-azanyl-4-(2-bromanyl-6-chloranyl-phenyl)-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-4-(2-bromanyl-6-chloranyl-phenyl)-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-(2-bromo-6-chloro-phenyl)-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(2-bromo-6-chlorophenyl)-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-(2-bromo-6-chlorophenyl)-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-(2-bromo-6-chloro-phenyl)-1-phenyl-3-propyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C22H18BrClN4O MolecularWeight: 469.76152

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=C(C=CC=C3Br)Cl)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=C(C=CC=C3Br)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H18BrClN4O/c1-2-7-17-20-18(19-15(23)10-6-11-16(19)24)14(12-25)21(26)29-22(20)28(27-17)13-8-4-3-5-9-13/h3-6,8-11,18H,2,7,26H2,1H3