N-(furan-2-ylmethyl)-N-[[2-(3-methoxyphenyl)-7-methylsulfanyl-quinolin-3-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide

Systemtic Name: N-(furan-2-ylmethyl)-N-[[2-(3-methoxyphenyl)-7-methylsulfanyl-quinolin-3-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide Openeye Name: N-(2-furylmethyl)-N-[[2-(3-methoxyphenyl)-7-methylsulfanyl-3-quinolyl]methyl]-3-(3-methylpyrazol-1-yl)propanamide CAS Name: N-(2-furanylmethyl)-N-[[2-(3-methoxyphenyl)-7-(methylthio)-3-quinolinyl]methyl]-3-(3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-(furan-2-ylmethyl)-N-[[2-(3-methoxyphenyl)-7-methylsulfanylquinolin-3-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide Traditional Name: N-(2-furfuryl)-N-[[2-(3-methoxyphenyl)-7-(methylthio)-3-quinolyl]methyl]-3-(3-methylpyrazol-1-yl)propionamide Formula: C30H30N4O3S MolecularWeight: 526.6492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H30N4O3S/c1-21-11-13-34(32-21)14-12-29(35)33(20-26-8-5-15-37-26)19-24-16-22-9-10-27(38-3)18-28(22)31-30(24)23-6-4-7-25(17-23)36-2/h4-11,13,15-18H,12,14,19-20H2,1-3H3