ethyl 2-[[4-(2-morpholin-4-ylphenoxy)pyrimidin-5-yl]carbamothioylamino]ethanoate

Systemtic Name: ethyl 2-[[4-(2-morpholin-4-ylphenoxy)pyrimidin-5-yl]carbamothioylamino]ethanoate Openeye Name: ethyl 2-[[4-(2-morpholinophenoxy)pyrimidin-5-yl]carbamothioylamino]acetate CAS Name: 2-[[[[4-[2-(4-morpholinyl)phenoxy]-5-pyrimidinyl]amino]-sulfanylidenemethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(2-morpholin-4-ylphenoxy)pyrimidin-5-yl]carbamothioylamino]acetate Traditional Name: 2-[[4-(2-morpholinophenoxy)pyrimidin-5-yl]thiocarbamoylamino]acetic acid ethyl ester Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)NC1=CN=CN=C1OC2=CC=CC=C2N3CCOCC3

Isomeric SMILES

CCOC(=O)CNC(=S)NC1=CN=CN=C1OC2=CC=CC=C2N3CCOCC3

InChI

InChI=1S/C19H23N5O4S/c1-2-27-17(25)12-21-19(29)23-14-11-20-13-22-18(14)28-16-6-4-3-5-15(16)24-7-9-26-10-8-24/h3-6,11,13H,2,7-10,12H2,1H3,(H2,21,23,29)