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

Systemtic Name: prop-2-enyl 4-methyl-6-[3-methyl-4-(2-thiophen-2-ylethanoyl)piperazin-1-yl]carbonyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: allyl 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 prop-2-enyl ester IUPAC Name: prop-2-enyl 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 allyl ester Formula: C27H28N4O4S MolecularWeight: 504.60062

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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)C)C(=O)OCC=C

Isomeric SMILES

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

InChI

InChI=1S/C27H28N4O4S/c1-4-14-35-27(34)23-19(3)28-25(20-9-6-5-7-10-20)29-24(23)26(33)30-12-13-31(18(2)17-30)22(32)16-21-11-8-15-36-21/h4-11,15,18H,1,12-14,16-17H2,2-3H3