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

Systemtic Name: 2-(benzo[g][1]benzothiol-2-ylmethylamino)-2-methyl-propane-1,3-diol Openeye Name: 2-(benzo[g]benzothiophen-2-ylmethylamino)-2-methyl-propane-1,3-diol CAS Name: 2-(2-benzo[g][1]benzothiolylmethylamino)-2-methylpropane-1,3-diol IUPAC Name: 2-(benzo[g][1]benzothiol-2-ylmethylamino)-2-methylpropane-1,3-diol Traditional Name: 2-(benzo[g]benzothiophen-2-ylmethylamino)-2-methyl-propane-1,3-diol Formula: C17H19NO2S MolecularWeight: 301.40326

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NCC1=CC2=C(S1)C3=CC=CC=C3C=C2

Isomeric SMILES

CC(CO)(CO)NCC1=CC2=C(S1)C3=CC=CC=C3C=C2

InChI

InChI=1S/C17H19NO2S/c1-17(10-19,11-20)18-9-14-8-13-7-6-12-4-2-3-5-15(12)16(13)21-14/h2-8,18-20H,9-11H2,1H3