2-methyl-2-(naphtho[2,1-f][1]benzothiol-7-ylmethylamino)propane-1,3-diol

Systemtic Name: 2-methyl-2-(naphtho[2,1-f][1]benzothiol-7-ylmethylamino)propane-1,3-diol Openeye Name: 2-methyl-2-(naphtho[2,1-f]benzothiophen-7-ylmethylamino)propane-1,3-diol CAS Name: 2-methyl-2-(7-naphtho[2,1-f][1]benzothiolylmethylamino)propane-1,3-diol IUPAC Name: 2-methyl-2-(naphtho[2,1-f][1]benzothiol-7-ylmethylamino)propane-1,3-diol Traditional Name: 2-methyl-2-(naphtho[2,1-f]benzothiophen-7-ylmethylamino)propane-1,3-diol Formula: C21H21NO2S MolecularWeight: 351.46194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NCC1=C2C=CC3=CC=CC=C3C2=CC4=C1C=CS4

Isomeric SMILES

CC(CO)(CO)NCC1=C2C=CC3=CC=CC=C3C2=CC4=C1C=CS4

InChI

InChI=1S/C21H21NO2S/c1-21(12-23,13-24)22-11-19-16-7-6-14-4-2-3-5-15(14)18(16)10-20-17(19)8-9-25-20/h2-10,22-24H,11-13H2,1H3