2-[methyl(3-phenylpropyl)amino]-1-(4-methylthiophen-2-yl)propane-1,3-diol

Systemtic Name: 2-[methyl(3-phenylpropyl)amino]-1-(4-methylthiophen-2-yl)propane-1,3-diol Openeye Name: 2-[methyl(3-phenylpropyl)amino]-1-(4-methyl-2-thienyl)propane-1,3-diol CAS Name: 2-[methyl(3-phenylpropyl)amino]-1-(4-methyl-2-thiophenyl)propane-1,3-diol IUPAC Name: 2-[methyl(3-phenylpropyl)amino]-1-(4-methylthiophen-2-yl)propane-1,3-diol Traditional Name: 2-[methyl(3-phenylpropyl)amino]-1-(4-methyl-2-thienyl)propane-1,3-diol Formula: C18H25NO2S MolecularWeight: 319.4616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(C(CO)N(C)CCCC2=CC=CC=C2)O

Isomeric SMILES

CC1=CSC(=C1)C(C(CO)N(C)CCCC2=CC=CC=C2)O

InChI

InChI=1S/C18H25NO2S/c1-14-11-17(22-13-14)18(21)16(12-20)19(2)10-6-9-15-7-4-3-5-8-15/h3-5,7-8,11,13,16,18,20-21H,6,9-10,12H2,1-2H3