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

Systemtic Name: methyl 4-(methoxymethyl)-6-[3-methyl-4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]carbonyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: methyl 4-(methoxymethyl)-6-[3-methyl-4-[2-(2-thienyl)acetyl]piperazine-1-carbonyl]-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-(methoxymethyl)-6-[[3-methyl-4-(1-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]-oxomethyl]-2-phenyl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(methoxymethyl)-6-[3-methyl-4-(2-thiophen-2-ylacetyl)piperazine-1-carbonyl]-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-(methoxymethyl)-6-[3-methyl-4-[2-(2-thienyl)acetyl]piperazine-1-carbonyl]-2-phenyl-pyrimidine-5-carboxylic acid methyl ester Formula: C26H28N4O5S MolecularWeight: 508.58932

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC2=CC=CS2)C(=O)C3=C(C(=NC(=N3)C4=CC=CC=C4)COC)C(=O)OC

Isomeric SMILES

CC1CN(CCN1C(=O)CC2=CC=CS2)C(=O)C3=C(C(=NC(=N3)C4=CC=CC=C4)COC)C(=O)OC

InChI

InChI=1S/C26H28N4O5S/c1-17-15-29(11-12-30(17)21(31)14-19-10-7-13-36-19)25(32)23-22(26(33)35-3)20(16-34-2)27-24(28-23)18-8-5-4-6-9-18/h4-10,13,17H,11-12,14-16H2,1-3H3