2-azanyl-9-[4-bis(oxidanyl)phosphinothioyloxy-5-[(9-phenylxanthen-9-yl)oxymethyl]oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[4-bis(oxidanyl)phosphinothioyloxy-5-[(9-phenylxanthen-9-yl)oxymethyl]oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[4-dihydroxyphosphinothioyloxy-5-[(9-phenylxanthen-9-yl)oxymethyl]tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[4-dihydroxyphosphinothioyloxy-5-[(9-phenyl-9-xanthenyl)oxymethyl]-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4-dihydroxyphosphinothioyloxy-5-[(9-phenylxanthen-9-yl)oxymethyl]oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[4-dihydroxythiophosphoryloxy-5-[(9-phenylxanthen-9-yl)oxymethyl]tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C29H26N5O7PS MolecularWeight: 619.584801

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)COC4(C5=CC=CC=C5OC6=CC=CC=C64)C7=CC=CC=C7)OP(=S)(O)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)COC4(C5=CC=CC=C5OC6=CC=CC=C64)C7=CC=CC=C7)OP(=S)(O)O

InChI

InChI=1S/C29H26N5O7PS/c30-28-32-26-25(27(35)33-28)31-16-34(26)24-14-22(41-42(36,37)43)23(40-24)15-38-29(17-8-2-1-3-9-17)18-10-4-6-12-20(18)39-21-13-7-5-11-19(21)29/h1-13,16,22-24H,14-15H2,(H2,36,37,43)(H3,30,32,33,35)