1-(4-butylsulfanylphenyl)-2-(dimethylamino)-3-phenyl-2-(phenylmethyl)propan-1-one

Systemtic Name: 1-(4-butylsulfanylphenyl)-2-(dimethylamino)-3-phenyl-2-(phenylmethyl)propan-1-one Openeye Name: 2-benzyl-1-(4-butylsulfanylphenyl)-2-(dimethylamino)-3-phenyl-propan-1-one CAS Name: 1-[4-(butylthio)phenyl]-2-(dimethylamino)-3-phenyl-2-(phenylmethyl)-1-propanone IUPAC Name: 2-benzyl-1-(4-butylsulfanylphenyl)-2-(dimethylamino)-3-phenylpropan-1-one Traditional Name: 2-benzyl-1-[4-(butylthio)phenyl]-2-(dimethylamino)-3-phenyl-propan-1-one Formula: C28H33NOS MolecularWeight: 431.63272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)C(=O)C(CC2=CC=CC=C2)(CC3=CC=CC=C3)N(C)C

Isomeric SMILES

CCCCSC1=CC=C(C=C1)C(=O)C(CC2=CC=CC=C2)(CC3=CC=CC=C3)N(C)C

InChI

InChI=1S/C28H33NOS/c1-4-5-20-31-26-18-16-25(17-19-26)27(30)28(29(2)3,21-23-12-8-6-9-13-23)22-24-14-10-7-11-15-24/h6-19H,4-5,20-22H2,1-3H3