3-[(2S,3S)-1-(4-chlorophenyl)-3-[[1-(3-chlorophenyl)-2-cyano-2-methyl-propyl]amino]butan-2-yl]benzenecarbonitrile

Systemtic Name: 3-[(2S,3S)-1-(4-chlorophenyl)-3-[[1-(3-chlorophenyl)-2-cyano-2-methyl-propyl]amino]butan-2-yl]benzenecarbonitrile Openeye Name: 3-[(1S,2S)-2-[[1-(3-chlorophenyl)-2-cyano-2-methyl-propyl]amino]-1-[(4-chlorophenyl)methyl]propyl]benzonitrile CAS Name: 3-[(2S,3S)-1-(4-chlorophenyl)-3-[[1-(3-chlorophenyl)-2-cyano-2-methylpropyl]amino]butan-2-yl]benzonitrile IUPAC Name: 3-[(2S,3S)-1-(4-chlorophenyl)-3-[[1-(3-chlorophenyl)-2-cyano-2-methylpropyl]amino]butan-2-yl]benzonitrile Traditional Name: 3-[(1S,2S)-1-(4-chlorobenzyl)-2-[[1-(3-chlorophenyl)-2-cyano-2-methyl-propyl]amino]propyl]benzonitrile Formula: C28H27Cl2N3 MolecularWeight: 476.44008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=C(C=C1)Cl)C2=CC=CC(=C2)C#N)NC(C3=CC(=CC=C3)Cl)C(C)(C)C#N

Isomeric SMILES

C[C@@H]([C@@H](CC1=CC=C(C=C1)Cl)C2=CC=CC(=C2)C#N)NC(C3=CC(=CC=C3)Cl)C(C)(C)C#N

InChI

InChI=1S/C28H27Cl2N3/c1-19(33-27(28(2,3)18-32)23-8-5-9-25(30)16-23)26(15-20-10-12-24(29)13-11-20)22-7-4-6-21(14-22)17-31/h4-14,16,19,26-27,33H,15H2,1-3H3/t19-,26+,27?/m0/s1