6-(dimethylamino)-4,4-diphenyl-heptan-3-one; N-[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonylpropanamide

Systemtic Name: 6-(dimethylamino)-4,4-diphenyl-heptan-3-one; N-[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonylpropanamide Openeye Name: 6-(dimethylamino)-4,4-diphenyl-heptan-3-one; N-[4-(5-methyl-3-phenyl-isoxazol-4-yl)phenyl]sulfonylpropanamide CAS Name: 6-(dimethylamino)-4,4-diphenyl-3-heptanone; N-[4-(5-methyl-3-phenyl-4-isoxazolyl)phenyl]sulfonylpropanamide IUPAC Name: 6-(dimethylamino)-4,4-diphenylheptan-3-one; N-[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonylpropanamide Traditional Name: 6-(dimethylamino)-4,4-diphenyl-heptan-3-one; N-[4-(5-methyl-3-phenyl-isoxazol-4-yl)phenyl]sulfonylpropionamide Formula: C40H45N3O5S MolecularWeight: 679.8674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CC(C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2.CCC(=O)NS(=O)(=O)C1=CC=C(C=C1)C2=C(ON=C2C3=CC=CC=C3)C

Isomeric SMILES

CCC(=O)C(CC(C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2.CCC(=O)NS(=O)(=O)C1=CC=C(C=C1)C2=C(ON=C2C3=CC=CC=C3)C

InChI

InChI=1S/C21H27NO.C19H18N2O4S/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19;1-3-17(22)21-26(23,24)16-11-9-14(10-12-16)18-13(2)25-20-19(18)15-7-5-4-6-8-15/h6-15,17H,5,16H2,1-4H3;4-12H,3H2,1-2H3,(H,21,22)