2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-methyl-1-(methylsulfanylmethyl)quinolin-4-one

Systemtic Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-methyl-1-(methylsulfanylmethyl)quinolin-4-one Openeye Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-methyl-1-(methylsulfanylmethyl)quinolin-4-one CAS Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-methyl-1-[(methylthio)methyl]-4-quinolinone IUPAC Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-methyl-1-(methylsulfanylmethyl)quinolin-4-one Traditional Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-methyl-1-[(methylthio)methyl]-4-quinolone Formula: C22H29NOS MolecularWeight: 355.53676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=C2C1=O)CSC)CC=C(C)CCC=C(C)C

Isomeric SMILES

CC1=C(N(C2=CC=CC=C2C1=O)CSC)C/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C22H29NOS/c1-16(2)9-8-10-17(3)13-14-20-18(4)22(24)19-11-6-7-12-21(19)23(20)15-25-5/h6-7,9,11-13H,8,10,14-15H2,1-5H3/b17-13+