[3-azido-5-(6-benzamidopurin-9-yl)-4-methoxy-oxolan-2-yl]methoxysulfanylphosphanylboron

Systemtic Name: [3-azido-5-(6-benzamidopurin-9-yl)-4-methoxy-oxolan-2-yl]methoxysulfanylphosphanylboron Openeye Name: [3-azido-5-(6-benzamidopurin-9-yl)-4-methoxy-tetrahydrofuran-2-yl]methoxysulfanylphosphanylboron CAS Name: [[3-azido-5-(6-benzamido-9-purinyl)-4-methoxy-2-oxolanyl]methoxythio]phosphinoboron IUPAC Name: [3-azido-5-(6-benzamidopurin-9-yl)-4-methoxyoxolan-2-yl]methoxysulfanylphosphanylboron Traditional Name: [[3-azido-5-(6-benzamidopurin-9-yl)-4-methoxy-tetrahydrofuran-2-yl]methoxythio]phosphinoboron Formula: C18H18BN8O4PS MolecularWeight: 484.236481

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Descriptors Computed from Structure

Canonical SMILES:

[B]PSOCC1C(C(C(O1)N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)OC)N=[N+]=[N-]

Isomeric SMILES

[B]PSOCC1C(C(C(O1)N2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)OC)N=[N+]=[N-]

InChI

InChI=1S/C18H18BN8O4PS/c1-29-14-12(25-26-20)11(7-30-33-32-19)31-18(14)27-9-23-13-15(21-8-22-16(13)27)24-17(28)10-5-3-2-4-6-10/h2-6,8-9,11-12,14,18,32H,7H2,1H3,(H,21,22,24,28)