N-cyclopropyl-2-[2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-keto-2-[methyl-(2,3,4-trimethoxybenzyl)amino]ethyl]thio]cinchoninamide Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C(=C(C=C1)OC)OC)OC)C(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

Isomeric SMILES

CN(CC1=C(C(=C(C=C1)OC)OC)OC)C(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

InChI

InChI=1S/C26H29N3O5S/c1-29(14-16-9-12-21(32-2)25(34-4)24(16)33-3)23(30)15-35-22-13-19(26(31)27-17-10-11-17)18-7-5-6-8-20(18)28-22/h5-9,12-13,17H,10-11,14-15H2,1-4H3,(H,27,31)