ethyl 2-[2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[1-oxo-2-[(6-phenyl-4-pyrimidinyl)thio]propyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[2-[(6-phenylpyrimidin-4-yl)thio]propanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C20H20N4O3S2 MolecularWeight: 428.5278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C(C)SC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C(C)SC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3S2/c1-3-27-18(25)9-15-11-28-20(23-15)24-19(26)13(2)29-17-10-16(21-12-22-17)14-7-5-4-6-8-14/h4-8,10-13H,3,9H2,1-2H3,(H,23,24,26)