4-(oxan-2-ylmethoxy)quinoline-3-carbothioamide

Systemtic Name: 4-(oxan-2-ylmethoxy)quinoline-3-carbothioamide Openeye Name: 4-(tetrahydropyran-2-ylmethoxy)quinoline-3-carbothioamide CAS Name: 4-(2-oxanylmethoxy)-3-quinolinecarbothioamide IUPAC Name: 4-(oxan-2-ylmethoxy)quinoline-3-carbothioamide Traditional Name: 4-(tetrahydropyran-2-ylmethoxy)quinoline-3-carbothioamide Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)COC2=C(C=NC3=CC=CC=C32)C(=S)N

Isomeric SMILES

C1CCOC(C1)COC2=C(C=NC3=CC=CC=C32)C(=S)N

InChI

InChI=1S/C16H18N2O2S/c17-16(21)13-9-18-14-7-2-1-6-12(14)15(13)20-10-11-5-3-4-8-19-11/h1-2,6-7,9,11H,3-5,8,10H2,(H2,17,21)