2-[2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]-methyl-amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]-methyl-amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[2-[2-(2-furylmethylcarbamoyl)-N-methyl-anilino]-2-oxo-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-[2-[(2-furanylmethylamino)-oxomethyl]-N-methylanilino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[2-[2-(furan-2-ylmethylcarbamoyl)-N-methylanilino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[2-[2-(2-furfurylcarbamoyl)-N-methyl-anilino]-2-keto-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C25H26N4O4 MolecularWeight: 446.49834

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCC2=CC=CO2)C(=O)CN3CC4=CC=CC=C4CC3C(=O)N

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCC2=CC=CO2)C(=O)CN3CC4=CC=CC=C4CC3C(=O)N

InChI

InChI=1S/C25H26N4O4/c1-28(21-11-5-4-10-20(21)25(32)27-14-19-9-6-12-33-19)23(30)16-29-15-18-8-3-2-7-17(18)13-22(29)24(26)31/h2-12,22H,13-16H2,1H3,(H2,26,31)(H,27,32)