methyl (4S)-6-methyl-4-phenyl-1-(phenylmethyl)-2-[(phenylmethyl)amino]-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-6-methyl-4-phenyl-1-(phenylmethyl)-2-[(phenylmethyl)amino]-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-1-benzyl-2-(benzylamino)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylate CAS Name: (4S)-6-methyl-4-phenyl-1-(phenylmethyl)-2-[(phenylmethyl)amino]-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-1-benzyl-2-(benzylamino)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-1-benzyl-2-(benzylamino)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1CC2=CC=CC=C2)NCC3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](N=C(N1CC2=CC=CC=C2)NCC3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C27H27N3O2/c1-20-24(26(31)32-2)25(23-16-10-5-11-17-23)29-27(28-18-21-12-6-3-7-13-21)30(20)19-22-14-8-4-9-15-22/h3-17,25H,18-19H2,1-2H3,(H,28,29)/t25-/m0/s1