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3-(hydroxymethyl)-N-pyridin-3-yl-3,4-dihydro-1H-isoquinoline-2-carbothioamide

3-(hydroxymethyl)-N-pyridin-3-yl-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name:3-(hydroxymethyl)-N-pyridin-3-yl-3,4-dihydro-1H-isoquinoline-2-carbothioamide
Openeye Name:3-(hydroxymethyl)-N-(3-pyridyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide
CAS Name:3-(hydroxymethyl)-N-(3-pyridinyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide
IUPAC Name:3-(hydroxymethyl)-N-pyridin-3-yl-3,4-dihydro-1H-isoquinoline-2-carbothioamide
Traditional Name:3-methylol-N-(3-pyridyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide
Formula: C16H17N3OS
MolecularWeight: 299.39068
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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=S)NC3=CN=CC=C3)CO


Isomeric SMILES

C1C(N(CC2=CC=CC=C21)C(=S)NC3=CN=CC=C3)CO


InChI

InChI=1S/C16H17N3OS/c20-11-15-8-12-4-1-2-5-13(12)10-19(15)16(21)18-14-6-3-7-17-9-14/h1-7,9,15,20H,8,10-11H2,(H,18,21)


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