2-[3-(5-oxidanyl-2,3-dihydro-1-benzofuran-6-yl)propyl]pyridine-3-carbothialdehyde

Systemtic Name: 2-[3-(5-oxidanyl-2,3-dihydro-1-benzofuran-6-yl)propyl]pyridine-3-carbothialdehyde Openeye Name: 2-[3-(5-hydroxy-2,3-dihydrobenzofuran-6-yl)propyl]pyridine-3-carbothialdehyde CAS Name: 2-[3-(5-hydroxy-2,3-dihydrobenzofuran-6-yl)propyl]-3-pyridinecarbothioaldehyde IUPAC Name: 2-[3-(5-hydroxy-2,3-dihydro-1-benzofuran-6-yl)propyl]pyridine-3-carbothialdehyde Traditional Name: 2-[3-(5-hydroxycoumaran-6-yl)propyl]thionicotinaldehyde Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC(=C(C=C21)O)CCCC3=C(C=CC=N3)C=S

Isomeric SMILES

C1COC2=CC(=C(C=C21)O)CCCC3=C(C=CC=N3)C=S

InChI

InChI=1S/C17H17NO2S/c19-16-9-13-6-8-20-17(13)10-12(16)3-1-5-15-14(11-21)4-2-7-18-15/h2,4,7,9-11,19H,1,3,5-6,8H2