ethyl 2-[2,4-bis(oxidanylidene)-3-(phenylmethyl)-1-propan-2-yl-pyrimidin-5-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[2,4-bis(oxidanylidene)-3-(phenylmethyl)-1-propan-2-yl-pyrimidin-5-yl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-(3-benzyl-1-isopropyl-2,4-dioxo-pyrimidin-5-yl)thiazole-4-carboxylate CAS Name: 2-[2,4-dioxo-3-(phenylmethyl)-1-propan-2-yl-5-pyrimidinyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-benzyl-2,4-dioxo-1-propan-2-ylpyrimidin-5-yl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-benzyl-1-isopropyl-2,4-diketo-pyrimidin-5-yl)thiazole-4-carboxylic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)C2=CN(C(=O)N(C2=O)CC3=CC=CC=C3)C(C)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)C2=CN(C(=O)N(C2=O)CC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C20H21N3O4S/c1-4-27-19(25)16-12-28-17(21-16)15-11-22(13(2)3)20(26)23(18(15)24)10-14-8-6-5-7-9-14/h5-9,11-13H,4,10H2,1-3H3