ethyl 2-[[4-(2,3-dimethoxyphenoxy)pyrimidin-5-yl]carbamothioylamino]ethanoate

Systemtic Name: ethyl 2-[[4-(2,3-dimethoxyphenoxy)pyrimidin-5-yl]carbamothioylamino]ethanoate Openeye Name: ethyl 2-[[4-(2,3-dimethoxyphenoxy)pyrimidin-5-yl]carbamothioylamino]acetate CAS Name: 2-[[[[4-(2,3-dimethoxyphenoxy)-5-pyrimidinyl]amino]-sulfanylidenemethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(2,3-dimethoxyphenoxy)pyrimidin-5-yl]carbamothioylamino]acetate Traditional Name: 2-[[4-(2,3-dimethoxyphenoxy)pyrimidin-5-yl]thiocarbamoylamino]acetic acid ethyl ester Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)NC1=CN=CN=C1OC2=C(C(=CC=C2)OC)OC

Isomeric SMILES

CCOC(=O)CNC(=S)NC1=CN=CN=C1OC2=C(C(=CC=C2)OC)OC

InChI

InChI=1S/C17H20N4O5S/c1-4-25-14(22)9-19-17(27)21-11-8-18-10-20-16(11)26-13-7-5-6-12(23-2)15(13)24-3/h5-8,10H,4,9H2,1-3H3,(H2,19,21,27)