(3S)-1-[2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylethanoyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-[2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylethanoyl]piperidine-3-carboxamide Openeye Name: (3S)-1-[2-[2-(2-furyl)quinazolin-4-yl]sulfanylacetyl]piperidine-3-carboxamide CAS Name: (3S)-1-[2-[[2-(2-furanyl)-4-quinazolinyl]thio]-1-oxoethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylacetyl]piperidine-3-carboxamide Traditional Name: (3S)-1-[2-[[2-(2-furyl)quinazolin-4-yl]thio]acetyl]nipecotamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CO4)C(=O)N

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CO4)C(=O)N

InChI

InChI=1S/C20H20N4O3S/c21-18(26)13-5-3-9-24(11-13)17(25)12-28-20-14-6-1-2-7-15(14)22-19(23-20)16-8-4-10-27-16/h1-2,4,6-8,10,13H,3,5,9,11-12H2,(H2,21,26)/t13-/m0/s1