ethyl 2-[2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]-4-phenyl-1,3-thiazol-5-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]-4-phenyl-1,3-thiazol-5-yl]ethanoate Openeye Name: ethyl 2-[2-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-4-phenyl-thiazol-5-yl]acetate CAS Name: 2-[2-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]-4-phenyl-5-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-4-phenyl-1,3-thiazol-5-yl]acetate Traditional Name: 2-[2-[[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]amino]-4-phenyl-thiazol-5-yl]acetic acid ethyl ester Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(N=C(S1)NC(=O)CSC2=NC(=CC(=N2)C)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC1=C(N=C(S1)NC(=O)CSC2=NC(=CC(=N2)C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3S2/c1-4-28-18(27)11-16-19(15-8-6-5-7-9-15)25-21(30-16)24-17(26)12-29-20-22-13(2)10-14(3)23-20/h5-10H,4,11-12H2,1-3H3,(H,24,25,26)