1-[2-diethoxyphosphinothioyloxy-3-phenylmethoxy-2-(phenylmethoxymethyl)propyl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[2-diethoxyphosphinothioyloxy-3-phenylmethoxy-2-(phenylmethoxymethyl)propyl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[3-benzyloxy-2-(benzyloxymethyl)-2-diethoxyphosphinothioyloxy-propyl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[2-diethoxyphosphinothioyloxy-3-phenylmethoxy-2-(phenylmethoxymethyl)propyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[2-diethoxyphosphinothioyloxy-3-phenylmethoxy-2-(phenylmethoxymethyl)propyl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[3-benzoxy-2-(benzoxymethyl)-2-diethoxythiophosphoryloxy-propyl]-5-methyl-pyrimidine-2,4-quinone Formula: C27H35N2O7PS MolecularWeight: 562.614761

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)OC(CN1C=C(C(=O)NC1=O)C)(COCC2=CC=CC=C2)COCC3=CC=CC=C3

Isomeric SMILES

CCOP(=S)(OCC)OC(CN1C=C(C(=O)NC1=O)C)(COCC2=CC=CC=C2)COCC3=CC=CC=C3

InChI

InChI=1S/C27H35N2O7PS/c1-4-34-37(38,35-5-2)36-27(20-32-17-23-12-8-6-9-13-23,21-33-18-24-14-10-7-11-15-24)19-29-16-22(3)25(30)28-26(29)31/h6-16H,4-5,17-21H2,1-3H3,(H,28,30,31)