N-[3-(2-imidazol-1-ylethoxy)phenyl]-4-thiophen-2-yl-pyrimidin-2-amine; 2-oxidanylpropanoic acid

Systemtic Name: N-[3-(2-imidazol-1-ylethoxy)phenyl]-4-thiophen-2-yl-pyrimidin-2-amine; 2-oxidanylpropanoic acid Openeye Name: 2-hydroxypropanoic acid; N-[3-(2-imidazol-1-ylethoxy)phenyl]-4-(2-thienyl)pyrimidin-2-amine CAS Name: 2-hydroxypropanoic acid; N-[3-[2-(1-imidazolyl)ethoxy]phenyl]-4-thiophen-2-yl-2-pyrimidinamine IUPAC Name: 2-hydroxypropanoic acid; N-[3-(2-imidazol-1-ylethoxy)phenyl]-4-thiophen-2-ylpyrimidin-2-amine Traditional Name: [3-(2-imidazol-1-ylethoxy)phenyl]-[4-(2-thienyl)pyrimidin-2-yl]amine; lactic acid Formula: C22H23N5O4S MolecularWeight: 453.51412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)O.C1=CC(=CC(=C1)OCCN2C=CN=C2)NC3=NC=CC(=N3)C4=CC=CS4

Isomeric SMILES

CC(C(=O)O)O.C1=CC(=CC(=C1)OCCN2C=CN=C2)NC3=NC=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C19H17N5OS.C3H6O3/c1-3-15(13-16(4-1)25-11-10-24-9-8-20-14-24)22-19-21-7-6-17(23-19)18-5-2-12-26-18;1-2(4)3(5)6/h1-9,12-14H,10-11H2,(H,21,22,23);2,4H,1H3,(H,5,6)