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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NCC1=C2C(=CC3=C1C=CC4=CC=CC=C43)C=CS2

Isomeric SMILES

CC(CO)(CO)NCC1=C2C(=CC3=C1C=CC4=CC=CC=C43)C=CS2

InChI

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