(3S)-3-(dimethylamino)-4-phenyl-1-[3-phenylpropyl(pyridin-4-ylmethyl)amino]butan-2-one

Systemtic Name: (3S)-3-(dimethylamino)-4-phenyl-1-[3-phenylpropyl(pyridin-4-ylmethyl)amino]butan-2-one Openeye Name: (3S)-3-(dimethylamino)-4-phenyl-1-[3-phenylpropyl(4-pyridylmethyl)amino]butan-2-one CAS Name: (3S)-3-(dimethylamino)-4-phenyl-1-[3-phenylpropyl(pyridin-4-ylmethyl)amino]-2-butanone IUPAC Name: (3S)-3-(dimethylamino)-4-phenyl-1-[3-phenylpropyl(pyridin-4-ylmethyl)amino]butan-2-one Traditional Name: (3S)-3-(dimethylamino)-4-phenyl-1-[3-phenylpropyl(4-pyridylmethyl)amino]butan-2-one Formula: C27H33N3O MolecularWeight: 415.57042

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CC1=CC=CC=C1)C(=O)CN(CCCC2=CC=CC=C2)CC3=CC=NC=C3

Isomeric SMILES

CN(C)[C@@H](CC1=CC=CC=C1)C(=O)CN(CCCC2=CC=CC=C2)CC3=CC=NC=C3

InChI

InChI=1S/C27H33N3O/c1-29(2)26(20-24-12-7-4-8-13-24)27(31)22-30(21-25-15-17-28-18-16-25)19-9-14-23-10-5-3-6-11-23/h3-8,10-13,15-18,26H,9,14,19-22H2,1-2H3/t26-/m0/s1