4-[3-(hydroxymethyl)piperidin-1-yl]quinoline-3-carbothioamide

Systemtic Name: 4-[3-(hydroxymethyl)piperidin-1-yl]quinoline-3-carbothioamide Openeye Name: 4-[3-(hydroxymethyl)-1-piperidyl]quinoline-3-carbothioamide CAS Name: 4-[3-(hydroxymethyl)-1-piperidinyl]-3-quinolinecarbothioamide IUPAC Name: 4-[3-(hydroxymethyl)piperidin-1-yl]quinoline-3-carbothioamide Traditional Name: 4-(3-methylolpiperidino)quinoline-3-carbothioamide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=NC3=CC=CC=C32)C(=S)N)CO

Isomeric SMILES

C1CC(CN(C1)C2=C(C=NC3=CC=CC=C32)C(=S)N)CO

InChI

InChI=1S/C16H19N3OS/c17-16(21)13-8-18-14-6-2-1-5-12(14)15(13)19-7-3-4-11(9-19)10-20/h1-2,5-6,8,11,20H,3-4,7,9-10H2,(H2,17,21)