triphenyl-(2-sulfanylidene-4,7-dihydro-1,3-thiazepin-3-yl)phosphanium chloride

Systemtic Name: triphenyl-(2-sulfanylidene-4,7-dihydro-1,3-thiazepin-3-yl)phosphanium chloride Openeye Name: triphenyl-(2-thioxo-4,7-dihydro-1,3-thiazepin-3-yl)phosphonium chloride CAS Name: triphenyl-(2-sulfanylidene-4,7-dihydro-1,3-thiazepin-3-yl)phosphonium chloride IUPAC Name: triphenyl-(2-sulfanylidene-4,7-dihydro-1,3-thiazepin-3-yl)phosphanium chloride Traditional Name: triphenyl-(2-thioxo-4,7-dihydro-1,3-thiazepin-3-yl)phosphonium chloride Formula: C23H21ClNPS2 MolecularWeight: 441.976301

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCSC(=S)N1[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1C=CCSC(=S)N1[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C23H21NPS2.ClH/c26-23-24(18-10-11-19-27-23)25(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22;/h1-17H,18-19H2;1H/q+1;/p-1