methyl (4S)-4-(4-bromophenyl)-2-[(4-methoxyphenyl)methylamino]-6-methyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-4-(4-bromophenyl)-2-[(4-methoxyphenyl)methylamino]-6-methyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-1-benzyl-4-(4-bromophenyl)-2-[(4-methoxyphenyl)methylamino]-6-methyl-4H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(4-bromophenyl)-2-[(4-methoxyphenyl)methylamino]-6-methyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-1-benzyl-4-(4-bromophenyl)-2-[(4-methoxyphenyl)methylamino]-6-methyl-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-1-benzyl-4-(4-bromophenyl)-6-methyl-2-(p-anisylamino)-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C28H28BrN3O3 MolecularWeight: 534.44422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H28BrN3O3/c1-19-25(27(33)35-3)26(22-11-13-23(29)14-12-22)31-28(32(19)18-21-7-5-4-6-8-21)30-17-20-9-15-24(34-2)16-10-20/h4-16,26H,17-18H2,1-3H3,(H,30,31)/t26-/m0/s1