methyl (4R,5R,6R)-1-ethyl-6-methyl-4-phenyl-2-(2-thiophen-2-ylethylamino)-5,6-dihydro-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4R,5R,6R)-1-ethyl-6-methyl-4-phenyl-2-(2-thiophen-2-ylethylamino)-5,6-dihydro-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4R,5R,6R)-1-ethyl-6-methyl-4-phenyl-2-[2-(2-thienyl)ethylamino]-5,6-dihydro-4H-pyrimidine-5-carboxylate CAS Name: (4R,5R,6R)-1-ethyl-6-methyl-4-phenyl-2-(2-thiophen-2-ylethylamino)-5,6-dihydro-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4R,5R,6R)-1-ethyl-6-methyl-4-phenyl-2-(2-thiophen-2-ylethylamino)-5,6-dihydro-4H-pyrimidine-5-carboxylate Traditional Name: (4R,5R,6R)-1-ethyl-6-methyl-4-phenyl-2-[2-(2-thienyl)ethylamino]-5,6-dihydro-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(C(C(N=C1NCCC2=CC=CS2)C3=CC=CC=C3)C(=O)OC)C

Isomeric SMILES

CCN1[C@@H]([C@H]([C@@H](N=C1NCCC2=CC=CS2)C3=CC=CC=C3)C(=O)OC)C

InChI

InChI=1S/C21H27N3O2S/c1-4-24-15(2)18(20(25)26-3)19(16-9-6-5-7-10-16)23-21(24)22-13-12-17-11-8-14-27-17/h5-11,14-15,18-19H,4,12-13H2,1-3H3,(H,22,23)/t15-,18-,19+/m1/s1