2-[[(R)-anthracen-9-yl-(4-chlorophenyl)sulfanyl-methyl]amino]phenol

Systemtic Name: 2-[[(R)-anthracen-9-yl-(4-chlorophenyl)sulfanyl-methyl]amino]phenol Openeye Name: 2-[[(R)-9-anthryl-(4-chlorophenyl)sulfanyl-methyl]amino]phenol CAS Name: 2-[[(R)-9-anthracenyl-[(4-chlorophenyl)thio]methyl]amino]phenol IUPAC Name: 2-[[(R)-anthracen-9-yl-(4-chlorophenyl)sulfanylmethyl]amino]phenol Traditional Name: 2-[[(R)-9-anthryl-[(4-chlorophenyl)thio]methyl]amino]phenol Formula: C27H20ClNOS MolecularWeight: 441.9718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(NC4=CC=CC=C4O)SC5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2[C@H](NC4=CC=CC=C4O)SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H20ClNOS/c28-20-13-15-21(16-14-20)31-27(29-24-11-5-6-12-25(24)30)26-22-9-3-1-7-18(22)17-19-8-2-4-10-23(19)26/h1-17,27,29-30H/t27-/m1/s1