N-[2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]adamantane-1-carboxamide

Systemtic Name: N-[2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]adamantane-1-carboxamide Openeye Name: N-[2-[2-(methylamino)-2-oxo-ethyl]sulfanyl-4-phenyl-thiazol-5-yl]adamantane-1-carboxamide CAS Name: N-[2-[[2-(methylamino)-2-oxoethyl]thio]-4-phenyl-5-thiazolyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[2-(methylamino)-2-oxoethyl]sulfanyl-4-phenyl-1,3-thiazol-5-yl]adamantane-1-carboxamide Traditional Name: N-[2-[[2-keto-2-(methylamino)ethyl]thio]-4-phenyl-thiazol-5-yl]adamantane-1-carboxamide Formula: C23H27N3O2S2 MolecularWeight: 441.60938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CSC1=NC(=C(S1)NC(=O)C23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5

Isomeric SMILES

CNC(=O)CSC1=NC(=C(S1)NC(=O)C23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5

InChI

InChI=1S/C23H27N3O2S2/c1-24-18(27)13-29-22-25-19(17-5-3-2-4-6-17)20(30-22)26-21(28)23-10-14-7-15(11-23)9-16(8-14)12-23/h2-6,14-16H,7-13H2,1H3,(H,24,27)(H,26,28)