O-(4-oxidanylbutyl) 5-(1H-pyrrol-2-yl)-2,3-dihydro-1H-pyrrolizine-1-carbothioate

Systemtic Name: O-(4-oxidanylbutyl) 5-(1H-pyrrol-2-yl)-2,3-dihydro-1H-pyrrolizine-1-carbothioate Openeye Name: O-(4-hydroxybutyl) 5-(1H-pyrrol-2-yl)-2,3-dihydro-1H-pyrrolizine-1-carbothioate CAS Name: 5-(1H-pyrrol-2-yl)-2,3-dihydro-1H-pyrrolizine-1-carbothioic acid O-(4-hydroxybutyl) ester IUPAC Name: O-(4-hydroxybutyl) 5-(1H-pyrrol-2-yl)-2,3-dihydro-1H-pyrrolizine-1-carbothioate Traditional Name: 5-(1H-pyrrol-2-yl)-2,3-dihydro-1H-pyrrolizine-1-carbothioic acid O-(4-hydroxybutyl) ester Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(=CC=C2C3=CC=CN3)C1C(=S)OCCCCO

Isomeric SMILES

C1CN2C(=CC=C2C3=CC=CN3)C1C(=S)OCCCCO

InChI

InChI=1S/C16H20N2O2S/c19-10-1-2-11-20-16(21)12-7-9-18-14(12)5-6-15(18)13-4-3-8-17-13/h3-6,8,12,17,19H,1-2,7,9-11H2