propan-2-yl 4-methyl-2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: propan-2-yl 4-methyl-2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: isopropyl 4-methyl-2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-[(6-phenyl-4-pyrimidinyl)thio]propyl]amino]-5-thiazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methyl-2-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[2-[(6-phenylpyrimidin-4-yl)thio]propanoylamino]thiazole-5-carboxylic acid isopropyl ester Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C(C)SC2=NC=NC(=C2)C3=CC=CC=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C(C)SC2=NC=NC(=C2)C3=CC=CC=C3)C(=O)OC(C)C

InChI

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