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

Systemtic Name: methyl (4S)-2-[(3-chlorophenyl)methylamino]-1-(cyclopropylmethyl)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-2-[(3-chlorophenyl)methylamino]-1-(cyclopropylmethyl)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylate CAS Name: (4S)-2-[(3-chlorophenyl)methylamino]-1-(cyclopropylmethyl)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-2-[(3-chlorophenyl)methylamino]-1-(cyclopropylmethyl)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-[(3-chlorobenzyl)amino]-1-(cyclopropylmethyl)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C24H26ClN3O2 MolecularWeight: 423.93514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1CC2CC2)NCC3=CC(=CC=C3)Cl)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](N=C(N1CC2CC2)NCC3=CC(=CC=C3)Cl)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C24H26ClN3O2/c1-16-21(23(29)30-2)22(19-8-4-3-5-9-19)27-24(28(16)15-17-11-12-17)26-14-18-7-6-10-20(25)13-18/h3-10,13,17,22H,11-12,14-15H2,1-2H3,(H,26,27)/t22-/m0/s1