6-azanyl-1-(4-iodophenyl)-3-methyl-4-(4-propan-2-ylphenyl)-6H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-1-(4-iodophenyl)-3-methyl-4-(4-propan-2-ylphenyl)-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-1-(4-iodophenyl)-4-(4-isopropylphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-1-(4-iodophenyl)-3-methyl-4-(4-propan-2-ylphenyl)-6H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-1-(4-iodophenyl)-3-methyl-4-(4-propan-2-ylphenyl)-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-1-(4-iodophenyl)-3-methyl-4-p-cumenyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C23H21IN4O MolecularWeight: 496.34351

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=C(C(O2)N)C#N)C3=CC=C(C=C3)C(C)C)C4=CC=C(C=C4)I

Isomeric SMILES

CC1=NN(C2=C1C(=C(C(O2)N)C#N)C3=CC=C(C=C3)C(C)C)C4=CC=C(C=C4)I

InChI

InChI=1S/C23H21IN4O/c1-13(2)15-4-6-16(7-5-15)21-19(12-25)22(26)29-23-20(21)14(3)27-28(23)18-10-8-17(24)9-11-18/h4-11,13,22H,26H2,1-3H3