methyl (4S)-2-[(3-chlorophenyl)methylamino]-6-methyl-4-phenyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-2-[(3-chlorophenyl)methylamino]-6-methyl-4-phenyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-1-benzyl-2-[(3-chlorophenyl)methylamino]-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylate CAS Name: (4S)-2-[(3-chlorophenyl)methylamino]-6-methyl-4-phenyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-1-benzyl-2-[(3-chlorophenyl)methylamino]-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-1-benzyl-2-[(3-chlorobenzyl)amino]-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C27H26ClN3O2 MolecularWeight: 459.96724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26ClN3O2/c1-19-24(26(32)33-2)25(22-13-7-4-8-14-22)30-27(29-17-21-12-9-15-23(28)16-21)31(19)18-20-10-5-3-6-11-20/h3-16,25H,17-18H2,1-2H3,(H,29,30)/t25-/m0/s1