S-(5,5-dimethyl-2-sulfanylidene-1,3,2$l^{5}-dioxaphosphinan-2-yl) 2-phenylethanethioate

Systemtic Name: S-(5,5-dimethyl-2-sulfanylidene-1,3,2$l^{5}-dioxaphosphinan-2-yl) 2-phenylethanethioate Openeye Name: S-(5,5-dimethyl-2-thioxo-1,3,2$l^{5}-dioxaphosphinan-2-yl) 2-phenylethanethioate CAS Name: 2-phenylethanethioic acid S-(5,5-dimethyl-2-sulfanylidene-1,3,2$l^{5}-dioxaphosphorinan-2-yl) ester IUPAC Name: S-(5,5-dimethyl-2-sulfanylidene-1,3,2$l^{5}-dioxaphosphinan-2-yl) 2-phenylethanethioate Traditional Name: 2-phenylethanethioic acid S-(5,5-dimethyl-2-thioxo-1,3,2$l^{5}-dioxaphosphorinan-2-yl) ester Formula: C13H17O3PS2 MolecularWeight: 316.376041

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COP(=S)(OC1)SC(=O)CC2=CC=CC=C2)C

Isomeric SMILES

CC1(COP(=S)(OC1)SC(=O)CC2=CC=CC=C2)C

InChI

InChI=1S/C13H17O3PS2/c1-13(2)9-15-17(18,16-10-13)19-12(14)8-11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3