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

Systemtic Name: 2-methyl-2-(naphtho[2,1-g][1]benzothiol-7-ylmethylamino)propane-1,3-diol Openeye Name: 2-methyl-2-(naphtho[2,1-g]benzothiophen-7-ylmethylamino)propane-1,3-diol CAS Name: 2-methyl-2-(7-naphtho[2,1-g][1]benzothiolylmethylamino)propane-1,3-diol IUPAC Name: 2-methyl-2-(naphtho[2,1-g][1]benzothiol-7-ylmethylamino)propane-1,3-diol Traditional Name: 2-methyl-2-(naphtho[2,1-g]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=CC2=C(C3=CC=CC=C31)C4=C(C=C2)C=CS4

Isomeric SMILES

CC(CO)(CO)NCC1=CC2=C(C3=CC=CC=C31)C4=C(C=C2)C=CS4

InChI

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