ethyl 4-methyl-6-[3-methyl-4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]carbonyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-methyl-6-[3-methyl-4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]carbonyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-methyl-6-[3-methyl-4-[2-(2-thienyl)acetyl]piperazine-1-carbonyl]-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-[[3-methyl-4-(1-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]-oxomethyl]-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-6-[3-methyl-4-(2-thiophen-2-ylacetyl)piperazine-1-carbonyl]-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-methyl-6-[3-methyl-4-[2-(2-thienyl)acetyl]piperazine-1-carbonyl]-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C26H28N4O4S MolecularWeight: 492.58992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1C)C2=CC=CC=C2)C(=O)N3CCN(C(C3)C)C(=O)CC4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C)C2=CC=CC=C2)C(=O)N3CCN(C(C3)C)C(=O)CC4=CC=CS4

InChI

InChI=1S/C26H28N4O4S/c1-4-34-26(33)22-18(3)27-24(19-9-6-5-7-10-19)28-23(22)25(32)29-12-13-30(17(2)16-29)21(31)15-20-11-8-14-35-20/h5-11,14,17H,4,12-13,15-16H2,1-3H3