6-(1-adamantylamino)pyridine-3-carbothioamide

Systemtic Name: 6-(1-adamantylamino)pyridine-3-carbothioamide Openeye Name: 6-(1-adamantylamino)pyridine-3-carbothioamide CAS Name: 6-(1-adamantylamino)-3-pyridinecarbothioamide IUPAC Name: 6-(1-adamantylamino)pyridine-3-carbothioamide Traditional Name: 6-(1-adamantylamino)thionicotinamide Formula: C16H21N3S MolecularWeight: 287.42304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC4=NC=C(C=C4)C(=S)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC4=NC=C(C=C4)C(=S)N

InChI

InChI=1S/C16H21N3S/c17-15(20)13-1-2-14(18-9-13)19-16-6-10-3-11(7-16)5-12(4-10)8-16/h1-2,9-12H,3-8H2,(H2,17,20)(H,18,19)