1-(furan-2-ylmethylsulfanyl)-4-phenyl-3-(3-phenylprop-1-ynylamino)butan-2-one

Systemtic Name: 1-(furan-2-ylmethylsulfanyl)-4-phenyl-3-(3-phenylprop-1-ynylamino)butan-2-one Openeye Name: 1-(2-furylmethylsulfanyl)-4-phenyl-3-(3-phenylprop-1-ynylamino)butan-2-one CAS Name: 1-(2-furanylmethylthio)-4-phenyl-3-(3-phenylprop-1-ynylamino)-2-butanone IUPAC Name: 1-(furan-2-ylmethylsulfanyl)-4-phenyl-3-(3-phenylprop-1-ynylamino)butan-2-one Traditional Name: 1-(2-furfurylthio)-4-phenyl-3-(3-phenylprop-1-ynylamino)butan-2-one Formula: C24H23NO2S MolecularWeight: 389.50992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC#CNC(CC2=CC=CC=C2)C(=O)CSCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)CC#CNC(CC2=CC=CC=C2)C(=O)CSCC3=CC=CO3

InChI

InChI=1S/C24H23NO2S/c26-24(19-28-18-22-14-8-16-27-22)23(17-21-11-5-2-6-12-21)25-15-7-13-20-9-3-1-4-10-20/h1-6,8-12,14,16,23,25H,13,17-19H2