ethyl 4-methyl-2-[[4-methyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[4-methyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[5-(4-benzylpiperazine-1-carbonyl)-4-methyl-pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-[[4-methyl-5-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-2-pyrimidinyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-(4-benzylpiperazine-1-carbonyl)-4-methylpyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[5-(4-benzylpiperazine-1-carbonyl)-4-methyl-pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C24H28N6O3S MolecularWeight: 480.58252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC2=NC=C(C(=N2)C)C(=O)N3CCN(CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC2=NC=C(C(=N2)C)C(=O)N3CCN(CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C24H28N6O3S/c1-4-33-22(32)20-17(3)27-24(34-20)28-23-25-14-19(16(2)26-23)21(31)30-12-10-29(11-13-30)15-18-8-6-5-7-9-18/h5-9,14H,4,10-13,15H2,1-3H3,(H,25,26,27,28)