4-[methyl(oxan-4-yl)amino]quinoline-3-carbothioamide

Systemtic Name: 4-[methyl(oxan-4-yl)amino]quinoline-3-carbothioamide Openeye Name: 4-[methyl(tetrahydropyran-4-yl)amino]quinoline-3-carbothioamide CAS Name: 4-[methyl(4-oxanyl)amino]-3-quinolinecarbothioamide IUPAC Name: 4-[methyl(oxan-4-yl)amino]quinoline-3-carbothioamide Traditional Name: 4-[methyl(tetrahydropyran-4-yl)amino]quinoline-3-carbothioamide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCOCC1)C2=C(C=NC3=CC=CC=C32)C(=S)N

Isomeric SMILES

CN(C1CCOCC1)C2=C(C=NC3=CC=CC=C32)C(=S)N

InChI

InChI=1S/C16H19N3OS/c1-19(11-6-8-20-9-7-11)15-12-4-2-3-5-14(12)18-10-13(15)16(17)21/h2-5,10-11H,6-9H2,1H3,(H2,17,21)