4-[[6-[[4-[(E)-2-cyanoprop-1-enyl]-2-methoxy-6-methyl-phenyl]amino]-7H-purin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[6-[[4-[(E)-2-cyanoprop-1-enyl]-2-methoxy-6-methyl-phenyl]amino]-7H-purin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[6-[4-[(E)-2-cyanoprop-1-enyl]-2-methoxy-6-methyl-anilino]-7H-purin-2-yl]amino]benzonitrile CAS Name: 4-[[6-[4-[(E)-2-cyanoprop-1-enyl]-2-methoxy-6-methylanilino]-7H-purin-2-yl]amino]benzonitrile IUPAC Name: 4-[[6-[4-[(E)-2-cyanoprop-1-enyl]-2-methoxy-6-methylanilino]-7H-purin-2-yl]amino]benzonitrile Traditional Name: 4-[[6-[4-[(E)-2-cyanoprop-1-enyl]-2-methoxy-6-methyl-anilino]-7H-purin-2-yl]amino]benzonitrile Formula: C24H20N8O MolecularWeight: 436.4686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C=C(C)C#N)OC)NC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C(=CC(=C1)/C=C(\C)/C#N)OC)NC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H20N8O/c1-14(11-25)8-17-9-15(2)20(19(10-17)33-3)30-23-21-22(28-13-27-21)31-24(32-23)29-18-6-4-16(12-26)5-7-18/h4-10,13H,1-3H3,(H3,27,28,29,30,31,32)/b14-8+