2-phenyl-3-(2-pyridin-2-ylethoxy)-4-pyrrolidin-1-yl-3-sulfanylidene-6,7-dihydro-5H-1,2,3$l^{5}-benzodiazaphosphole

Systemtic Name: 2-phenyl-3-(2-pyridin-2-ylethoxy)-4-pyrrolidin-1-yl-3-sulfanylidene-6,7-dihydro-5H-1,2,3$l^{5}-benzodiazaphosphole Openeye Name: 2-phenyl-3-[2-(2-pyridyl)ethoxy]-4-pyrrolidin-1-yl-3-thioxo-6,7-dihydro-5H-1,2,3$l^{5}-benzodiazaphosphole CAS Name: 2-phenyl-3-[2-(2-pyridinyl)ethoxy]-4-(1-pyrrolidinyl)-3-sulfanylidene-6,7-dihydro-5H-1,2,3$l^{5}-benzodiazaphosphole IUPAC Name: 2-phenyl-3-(2-pyridin-2-ylethoxy)-4-pyrrolidin-1-yl-3-sulfanylidene-6,7-dihydro-5H-1,2,3$l^{5}-benzodiazaphosphole Traditional Name: 2-phenyl-3-[2-(2-pyridyl)ethoxy]-4-pyrrolidino-3-thioxo-6,7-dihydro-5H-1,2,3$l^{5}-benzodiazaphosphole Formula: C23H27N4OPS MolecularWeight: 438.525441

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C3C(=NN(P3(=S)OCCC4=CC=CC=N4)C5=CC=CC=C5)CCC2

Isomeric SMILES

C1CCN(C1)C2=C3C(=NN(P3(=S)OCCC4=CC=CC=N4)C5=CC=CC=C5)CCC2

InChI

InChI=1S/C23H27N4OPS/c30-29(28-18-14-19-9-4-5-15-24-19)23-21(25-27(29)20-10-2-1-3-11-20)12-8-13-22(23)26-16-6-7-17-26/h1-5,9-11,15H,6-8,12-14,16-18H2