(4S,5R,6R)-1-ethyl-6-methyl-4-phenethyl-N-(2-thiophen-2-ylethyl)-2-(2-thiophen-2-ylethylamino)-5,6-dihydro-4H-pyrimidine-5-carboxamide

Systemtic Name: (4S,5R,6R)-1-ethyl-6-methyl-4-phenethyl-N-(2-thiophen-2-ylethyl)-2-(2-thiophen-2-ylethylamino)-5,6-dihydro-4H-pyrimidine-5-carboxamide Openeye Name: (4S,5R,6R)-1-ethyl-6-methyl-4-phenethyl-N-[2-(2-thienyl)ethyl]-2-[2-(2-thienyl)ethylamino]-5,6-dihydro-4H-pyrimidine-5-carboxamide CAS Name: (4S,5R,6R)-1-ethyl-6-methyl-4-phenethyl-N-(2-thiophen-2-ylethyl)-2-(2-thiophen-2-ylethylamino)-5,6-dihydro-4H-pyrimidine-5-carboxamide IUPAC Name: (4S,5R,6R)-1-ethyl-6-methyl-4-phenethyl-N-(2-thiophen-2-ylethyl)-2-(2-thiophen-2-ylethylamino)-5,6-dihydro-4H-pyrimidine-5-carboxamide Traditional Name: (4S,5R,6R)-1-ethyl-6-methyl-4-phenethyl-N-[2-(2-thienyl)ethyl]-2-[2-(2-thienyl)ethylamino]-5,6-dihydro-4H-pyrimidine-5-carboxamide Formula: C28H36N4OS2 MolecularWeight: 508.74164

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C(C(N=C1NCCC2=CC=CS2)CCC3=CC=CC=C3)C(=O)NCCC4=CC=CS4)C

Isomeric SMILES

CCN1[C@@H]([C@H]([C@@H](N=C1NCCC2=CC=CS2)CCC3=CC=CC=C3)C(=O)NCCC4=CC=CS4)C

InChI

InChI=1S/C28H36N4OS2/c1-3-32-21(2)26(27(33)29-17-15-23-11-7-19-34-23)25(14-13-22-9-5-4-6-10-22)31-28(32)30-18-16-24-12-8-20-35-24/h4-12,19-21,25-26H,3,13-18H2,1-2H3,(H,29,33)(H,30,31)/t21-,25+,26-/m1/s1