2-[(E)-but-2-enoxy]-4-(but-3-enylamino)-5-methyl-1-(2-methylsulfanylphenyl)hex-4-en-1-one

Systemtic Name: 2-[(E)-but-2-enoxy]-4-(but-3-enylamino)-5-methyl-1-(2-methylsulfanylphenyl)hex-4-en-1-one Openeye Name: 2-[(E)-but-2-enoxy]-4-(but-3-enylamino)-5-methyl-1-(2-methylsulfanylphenyl)hex-4-en-1-one CAS Name: 2-[(E)-but-2-enoxy]-4-(but-3-enylamino)-5-methyl-1-[2-(methylthio)phenyl]-4-hexen-1-one IUPAC Name: 2-[(E)-but-2-enoxy]-4-(but-3-enylamino)-5-methyl-1-(2-methylsulfanylphenyl)hex-4-en-1-one Traditional Name: 2-[(E)-but-2-enoxy]-4-(but-3-enylamino)-5-methyl-1-[2-(methylthio)phenyl]hex-4-en-1-one Formula: C22H31NO2S MolecularWeight: 373.55204

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCOC(CC(=C(C)C)NCCC=C)C(=O)C1=CC=CC=C1SC

Isomeric SMILES

C/C=C/COC(CC(=C(C)C)NCCC=C)C(=O)C1=CC=CC=C1SC

InChI

InChI=1S/C22H31NO2S/c1-6-8-14-23-19(17(3)4)16-20(25-15-9-7-2)22(24)18-12-10-11-13-21(18)26-5/h6-7,9-13,20,23H,1,8,14-16H2,2-5H3/b9-7+