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

Systemtic Name: methyl 4-(methoxymethyl)-6-(3-methyl-4-thiophen-2-ylcarbonyl-piperazin-1-yl)carbonyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: methyl 4-(methoxymethyl)-6-[3-methyl-4-(thiophene-2-carbonyl)piperazine-1-carbonyl]-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-(methoxymethyl)-6-[[3-methyl-4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-oxomethyl]-2-phenyl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(methoxymethyl)-6-[3-methyl-4-(thiophene-2-carbonyl)piperazine-1-carbonyl]-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-(methoxymethyl)-6-[3-methyl-4-(2-thenoyl)piperazine-1-carbonyl]-2-phenyl-pyrimidine-5-carboxylic acid methyl ester Formula: C25H26N4O5S MolecularWeight: 494.56274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC=CS2)C(=O)C3=C(C(=NC(=N3)C4=CC=CC=C4)COC)C(=O)OC

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC=CS2)C(=O)C3=C(C(=NC(=N3)C4=CC=CC=C4)COC)C(=O)OC

InChI

InChI=1S/C25H26N4O5S/c1-16-14-28(11-12-29(16)23(30)19-10-7-13-35-19)24(31)21-20(25(32)34-3)18(15-33-2)26-22(27-21)17-8-5-4-6-9-17/h4-10,13,16H,11-12,14-15H2,1-3H3