N-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)methanamine; pentanedioic acid

Systemtic Name: N-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)methanamine; pentanedioic acid Openeye Name: glutaric acid; 1-(2-isopropylthiazol-4-yl)-N-methyl-methanamine CAS Name: N-methyl-1-(2-propan-2-yl-4-thiazolyl)methanamine; pentanedioic acid IUPAC Name: N-methyl-1-(2-propan-2-yl-1,3-thiazol-4-yl)methanamine; pentanedioic acid Traditional Name: glutaric acid; (2-isopropylthiazol-4-yl)methyl-methyl-amine Formula: C13H22N2O4S MolecularWeight: 302.38978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=CS1)CNC.C(CC(=O)O)CC(=O)O

Isomeric SMILES

CC(C)C1=NC(=CS1)CNC.C(CC(=O)O)CC(=O)O

InChI

InChI=1S/C8H14N2S.C5H8O4/c1-6(2)8-10-7(4-9-3)5-11-8;6-4(7)2-1-3-5(8)9/h5-6,9H,4H2,1-3H3;1-3H2,(H,6,7)(H,8,9)