N-(2-methoxyphenyl)-2-[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-2-[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: 2-[2-[benzyl(methyl)amino]-2-oxo-ethyl]sulfanyl-N-(2-methoxyphenyl)quinoline-4-carboxamide CAS Name: N-(2-methoxyphenyl)-2-[[2-[methyl-(phenylmethyl)amino]-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: 2-[2-[benzyl(methyl)amino]-2-oxoethyl]sulfanyl-N-(2-methoxyphenyl)quinoline-4-carboxamide Traditional Name: 2-[[2-[benzyl(methyl)amino]-2-keto-ethyl]thio]-N-(2-methoxyphenyl)cinchoninamide Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4OC

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4OC

InChI

InChI=1S/C27H25N3O3S/c1-30(17-19-10-4-3-5-11-19)26(31)18-34-25-16-21(20-12-6-7-13-22(20)28-25)27(32)29-23-14-8-9-15-24(23)33-2/h3-16H,17-18H2,1-2H3,(H,29,32)