2-azanyl-6-chloranyl-9-[(4-iodanyl-3,5-dimethyl-pyridin-2-yl)methyl]-7-(2-pyrrol-1-ylethyl)purin-8-one

Systemtic Name: 2-azanyl-6-chloranyl-9-[(4-iodanyl-3,5-dimethyl-pyridin-2-yl)methyl]-7-(2-pyrrol-1-ylethyl)purin-8-one Openeye Name: 2-amino-6-chloro-9-[(4-iodo-3,5-dimethyl-2-pyridyl)methyl]-7-(2-pyrrol-1-ylethyl)purin-8-one CAS Name: 2-amino-6-chloro-9-[(4-iodo-3,5-dimethyl-2-pyridinyl)methyl]-7-[2-(1-pyrrolyl)ethyl]-8-purinone IUPAC Name: 2-amino-6-chloro-9-[(4-iodo-3,5-dimethylpyridin-2-yl)methyl]-7-(2-pyrrol-1-ylethyl)purin-8-one Traditional Name: 2-amino-6-chloro-9-[(4-iodo-3,5-dimethyl-2-pyridyl)methyl]-7-(2-pyrrol-1-ylethyl)purin-8-one Formula: C19H19ClIN7O MolecularWeight: 523.75793

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1I)C)CN2C3=C(C(=NC(=N3)N)Cl)N(C2=O)CCN4C=CC=C4

Isomeric SMILES

CC1=CN=C(C(=C1I)C)CN2C3=C(C(=NC(=N3)N)Cl)N(C2=O)CCN4C=CC=C4

InChI

InChI=1S/C19H19ClIN7O/c1-11-9-23-13(12(2)14(11)21)10-28-17-15(16(20)24-18(22)25-17)27(19(28)29)8-7-26-5-3-4-6-26/h3-6,9H,7-8,10H2,1-2H3,(H2,22,24,25)