diethoxy-[6-methyl-5-(phenylmethyl)-2-pyrrolidin-1-yl-pyrimidin-4-yl]oxy-sulfanylidene-$l^{5}-phosphane

Systemtic Name: diethoxy-[6-methyl-5-(phenylmethyl)-2-pyrrolidin-1-yl-pyrimidin-4-yl]oxy-sulfanylidene-$l^{5}-phosphane Openeye Name: (5-benzyl-6-methyl-2-pyrrolidin-1-yl-pyrimidin-4-yl)oxy-diethoxy-thioxo-$l^{5}-phosphane CAS Name: diethoxy-[[6-methyl-5-(phenylmethyl)-2-(1-pyrrolidinyl)-4-pyrimidinyl]oxy]-sulfanylidenephosphorane IUPAC Name: (5-benzyl-6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)oxy-diethoxy-sulfanylidene-$l^{5}-phosphane Traditional Name: (5-benzyl-6-methyl-2-pyrrolidino-pyrimidin-4-yl)oxy-diethoxy-thioxo-phosphorane Formula: C20H28N3O3PS MolecularWeight: 421.493381

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)OC1=NC(=NC(=C1CC2=CC=CC=C2)C)N3CCCC3

Isomeric SMILES

CCOP(=S)(OCC)OC1=NC(=NC(=C1CC2=CC=CC=C2)C)N3CCCC3

InChI

InChI=1S/C20H28N3O3PS/c1-4-24-27(28,25-5-2)26-19-18(15-17-11-7-6-8-12-17)16(3)21-20(22-19)23-13-9-10-14-23/h6-8,11-12H,4-5,9-10,13-15H2,1-3H3