dimethyl 2-(2-sulfanylideneimidazolidin-1-yl)-3-(triphenyl-$l^{5}-phosphanylidene)butanedioate

Systemtic Name: dimethyl 2-(2-sulfanylideneimidazolidin-1-yl)-3-(triphenyl-$l^{5}-phosphanylidene)butanedioate Openeye Name: dimethyl 2-(2-thioxoimidazolidin-1-yl)-3-(triphenyl-$l^{5}-phosphanylidene)butanedioate CAS Name: 2-(2-sulfanylidene-1-imidazolidinyl)-3-triphenylphosphoranylidenebutanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(2-sulfanylideneimidazolidin-1-yl)-3-(triphenyl-$l^{5}-phosphanylidene)butanedioate Traditional Name: 2-(2-thioxoimidazolidin-1-yl)-3-triphenylphosphoranylidene-succinic acid dimethyl ester Formula: C27H27N2O4PS MolecularWeight: 506.553041

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)N4CCNC4=S

Isomeric SMILES

COC(=O)C(C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)N4CCNC4=S

InChI

InChI=1S/C27H27N2O4PS/c1-32-25(30)23(29-19-18-28-27(29)35)24(26(31)33-2)34(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22/h3-17,23H,18-19H2,1-2H3,(H,28,35)