ethyl 2-[2-[2-(6-methylpyrimidin-4-yl)sulfanylbutanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(6-methylpyrimidin-4-yl)sulfanylbutanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(6-methylpyrimidin-4-yl)sulfanylbutanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-[(6-methyl-4-pyrimidinyl)thio]-1-oxobutyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(6-methylpyrimidin-4-yl)sulfanylbutanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[2-[(6-methylpyrimidin-4-yl)thio]butanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C16H20N4O3S2 MolecularWeight: 380.485

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=CS1)CC(=O)OCC)SC2=NC=NC(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=NC(=CS1)CC(=O)OCC)SC2=NC=NC(=C2)C

InChI

InChI=1S/C16H20N4O3S2/c1-4-12(25-13-6-10(3)17-9-18-13)15(22)20-16-19-11(8-24-16)7-14(21)23-5-2/h6,8-9,12H,4-5,7H2,1-3H3,(H,19,20,22)