2-chloranyl-5-methyl-6-pyrrolidin-1-yl-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinine

Systemtic Name: 2-chloranyl-5-methyl-6-pyrrolidin-1-yl-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinine Openeye Name: 2-chloro-5-methyl-6-pyrrolidin-1-yl-6-thioxo-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinine CAS Name: 2-chloro-5-methyl-6-(1-pyrrolidinyl)-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphorine IUPAC Name: 2-chloro-5-methyl-6-pyrrolidin-1-yl-6-sulfanylidene-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphinine Traditional Name: 2-chloro-5-methyl-6-pyrrolidino-6-thioxo-9,13b-dihydro-8H-isoquinolino[2,1-c][1,3,2]benzodiazaphosphorine Formula: C20H23ClN3PS MolecularWeight: 403.908481

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Cl)C3C4=CC=CC=C4CCN3P1(=S)N5CCCC5

Isomeric SMILES

CN1C2=C(C=C(C=C2)Cl)C3C4=CC=CC=C4CCN3P1(=S)N5CCCC5

InChI

InChI=1S/C20H23ClN3PS/c1-22-19-9-8-16(21)14-18(19)20-17-7-3-2-6-15(17)10-13-24(20)25(22,26)23-11-4-5-12-23/h2-3,6-9,14,20H,4-5,10-13H2,1H3