2-(4-methylpentoxy)pyridine-4-carbothioamide

Systemtic Name: 2-(4-methylpentoxy)pyridine-4-carbothioamide Openeye Name: 2-isohexyloxypyridine-4-carbothioamide CAS Name: 2-(4-methylpentoxy)-4-pyridinecarbothioamide IUPAC Name: 2-(4-methylpentoxy)pyridine-4-carbothioamide Traditional Name: 2-isohexyloxythioisonicotinamide Formula: C12H18N2OS MolecularWeight: 238.34912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1=NC=CC(=C1)C(=S)N

Isomeric SMILES

CC(C)CCCOC1=NC=CC(=C1)C(=S)N

InChI

InChI=1S/C12H18N2OS/c1-9(2)4-3-7-15-11-8-10(12(13)16)5-6-14-11/h5-6,8-9H,3-4,7H2,1-2H3,(H2,13,16)