(3S)-3-azanyl-4-(1H-imidazol-5-yl)-1-[4-(4-methylphenyl)phenyl]butan-2-one

Systemtic Name: (3S)-3-azanyl-4-(1H-imidazol-5-yl)-1-[4-(4-methylphenyl)phenyl]butan-2-one Openeye Name: (3S)-3-amino-4-(1H-imidazol-5-yl)-1-[4-(p-tolyl)phenyl]butan-2-one CAS Name: (3S)-3-amino-4-(1H-imidazol-5-yl)-1-[4-(4-methylphenyl)phenyl]-2-butanone IUPAC Name: (3S)-3-amino-4-(1H-imidazol-5-yl)-1-[4-(4-methylphenyl)phenyl]butan-2-one Traditional Name: (3S)-3-amino-4-(1H-imidazol-5-yl)-1-[4-(p-tolyl)phenyl]butan-2-one Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)C(CC3=CN=CN3)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)[C@H](CC3=CN=CN3)N

InChI

InChI=1S/C20H21N3O/c1-14-2-6-16(7-3-14)17-8-4-15(5-9-17)10-20(24)19(21)11-18-12-22-13-23-18/h2-9,12-13,19H,10-11,21H2,1H3,(H,22,23)/t19-/m0/s1