2-[(S)-(4-methylphenyl)sulfinyl]pyrrole; ruthenium(2+); (2,3,4,5-tetraphenylcyclopentyl)benzene

Systemtic Name: 2-[(S)-(4-methylphenyl)sulfinyl]pyrrole; ruthenium(2+); (2,3,4,5-tetraphenylcyclopentyl)benzene Openeye Name: 2-[(S)-p-tolylsulfinyl]pyrrole; ruthenium(2+); (2,3,4,5-tetraphenylcyclopentyl)benzene CAS Name: 2-[(S)-(4-methylphenyl)sulfinyl]pyrrole; ruthenium(2+); (2,3,4,5-tetraphenylcyclopentyl)benzene IUPAC Name: 2-[(S)-(4-methylphenyl)sulfinyl]pyrrole; ruthenium(2+); (2,3,4,5-tetraphenylcyclopentyl)benzene Traditional Name: 2-[(S)-p-tolylsulfinyl]pyrrole; ruthenium(2+); (2,3,4,5-tetraphenylcyclopentyl)benzene Formula: C46H35NORuS+2 MolecularWeight: 750.9112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)[C]2[CH][CH][CH][N]2.C1=CC=C(C=C1)[C]2[C]([C]([C]([C]2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6.[Ru+2]

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)[C]2[CH][CH][CH][N]2.C1=CC=C(C=C1)[C]2[C]([C]([C]([C]2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6.[Ru+2]

InChI

InChI=1S/C35H25.C11H10NOS.Ru/c1-6-16-26(17-7-1)31-32(27-18-8-2-9-19-27)34(29-22-12-4-13-23-29)35(30-24-14-5-15-25-30)33(31)28-20-10-3-11-21-28;1-9-4-6-10(7-5-9)14(13)11-3-2-8-12-11;/h1-25H;2-8H,1H3;/q;;+2/t;14-;/m.0./s1