N-(furan-2-ylmethyl)-N-[[2-(3-methoxyphenyl)-7-methylsulfanyl-quinolin-3-yl]methyl]-4-methyl-benzamide

Systemtic Name: N-(furan-2-ylmethyl)-N-[[2-(3-methoxyphenyl)-7-methylsulfanyl-quinolin-3-yl]methyl]-4-methyl-benzamide Openeye Name: N-(2-furylmethyl)-N-[[2-(3-methoxyphenyl)-7-methylsulfanyl-3-quinolyl]methyl]-4-methyl-benzamide CAS Name: N-(2-furanylmethyl)-N-[[2-(3-methoxyphenyl)-7-(methylthio)-3-quinolinyl]methyl]-4-methylbenzamide IUPAC Name: N-(furan-2-ylmethyl)-N-[[2-(3-methoxyphenyl)-7-methylsulfanylquinolin-3-yl]methyl]-4-methylbenzamide Traditional Name: N-(2-furfuryl)-N-[[2-(3-methoxyphenyl)-7-(methylthio)-3-quinolyl]methyl]-4-methyl-benzamide Formula: C31H28N2O3S MolecularWeight: 508.63062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2=CC=CO2)CC3=C(N=C4C=C(C=CC4=C3)SC)C5=CC(=CC=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2=CC=CO2)CC3=C(N=C4C=C(C=CC4=C3)SC)C5=CC(=CC=C5)OC

InChI

InChI=1S/C31H28N2O3S/c1-21-9-11-22(12-10-21)31(34)33(20-27-8-5-15-36-27)19-25-16-23-13-14-28(37-3)18-29(23)32-30(25)24-6-4-7-26(17-24)35-2/h4-18H,19-20H2,1-3H3