[4-[(2-iodanyl-7H-purin-6-yl)amino]phenyl]-piperidin-1-yl-methanone

Systemtic Name: [4-[(2-iodanyl-7H-purin-6-yl)amino]phenyl]-piperidin-1-yl-methanone Openeye Name: [4-[(2-iodo-7H-purin-6-yl)amino]phenyl]-(1-piperidyl)methanone CAS Name: [4-[(2-iodo-7H-purin-6-yl)amino]phenyl]-(1-piperidinyl)methanone IUPAC Name: [4-[(2-iodo-7H-purin-6-yl)amino]phenyl]-piperidin-1-ylmethanone Traditional Name: [4-[(2-iodo-7H-purin-6-yl)amino]phenyl]-piperidino-methanone Formula: C17H17IN6O MolecularWeight: 448.26095

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=NC(=NC4=C3NC=N4)I

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=NC(=NC4=C3NC=N4)I

InChI

InChI=1S/C17H17IN6O/c18-17-22-14-13(19-10-20-14)15(23-17)21-12-6-4-11(5-7-12)16(25)24-8-2-1-3-9-24/h4-7,10H,1-3,8-9H2,(H2,19,20,21,22,23)