methyl (4S)-2-(cyclopropylmethylamino)-6-methyl-4-phenyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-2-(cyclopropylmethylamino)-6-methyl-4-phenyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-1-benzyl-2-(cyclopropylmethylamino)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylate CAS Name: (4S)-2-(cyclopropylmethylamino)-6-methyl-4-phenyl-1-(phenylmethyl)-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-1-benzyl-2-(cyclopropylmethylamino)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-1-benzyl-2-(cyclopropylmethylamino)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C24H27N3O2 MolecularWeight: 389.49008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1CC2=CC=CC=C2)NCC3CC3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](N=C(N1CC2=CC=CC=C2)NCC3CC3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C24H27N3O2/c1-17-21(23(28)29-2)22(20-11-7-4-8-12-20)26-24(25-15-18-13-14-18)27(17)16-19-9-5-3-6-10-19/h3-12,18,22H,13-16H2,1-2H3,(H,25,26)/t22-/m0/s1