6-[(4-chlorophenyl)methylamino]-9-(pyridin-3-ylmethyl)purine-2-carbonitrile

Systemtic Name: 6-[(4-chlorophenyl)methylamino]-9-(pyridin-3-ylmethyl)purine-2-carbonitrile Openeye Name: 6-[(4-chlorophenyl)methylamino]-9-(3-pyridylmethyl)purine-2-carbonitrile CAS Name: 6-[(4-chlorophenyl)methylamino]-9-(3-pyridinylmethyl)-2-purinecarbonitrile IUPAC Name: 6-[(4-chlorophenyl)methylamino]-9-(pyridin-3-ylmethyl)purine-2-carbonitrile Traditional Name: 6-[(4-chlorobenzyl)amino]-9-(3-pyridylmethyl)purine-2-carbonitrile Formula: C19H14ClN7 MolecularWeight: 375.81436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN2C=NC3=C2N=C(N=C3NCC4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

C1=CC(=CN=C1)CN2C=NC3=C2N=C(N=C3NCC4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C19H14ClN7/c20-15-5-3-13(4-6-15)10-23-18-17-19(26-16(8-21)25-18)27(12-24-17)11-14-2-1-7-22-9-14/h1-7,9,12H,10-11H2,(H,23,25,26)