1-(2-oxidanylnonan-3-yl)imidazole-4-carbothioamide

Systemtic Name: 1-(2-oxidanylnonan-3-yl)imidazole-4-carbothioamide Openeye Name: 1-[1-(1-hydroxyethyl)heptyl]imidazole-4-carbothioamide CAS Name: 1-(2-hydroxynonan-3-yl)-4-imidazolecarbothioamide IUPAC Name: 1-(2-hydroxynonan-3-yl)imidazole-4-carbothioamide Traditional Name: 1-[1-(1-hydroxyethyl)heptyl]imidazole-4-carbothioamide Formula: C13H23N3OS MolecularWeight: 269.40622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)O)N1C=C(N=C1)C(=S)N

Isomeric SMILES

CCCCCCC(C(C)O)N1C=C(N=C1)C(=S)N

InChI

InChI=1S/C13H23N3OS/c1-3-4-5-6-7-12(10(2)17)16-8-11(13(14)18)15-9-16/h8-10,12,17H,3-7H2,1-2H3,(H2,14,18)