N-[5-(1-adamantyl)-1,3-thiazol-2-yl]-2-(1,3-benzothiazol-2-ylsulfanyl)ethanamide

Systemtic Name: N-[5-(1-adamantyl)-1,3-thiazol-2-yl]-2-(1,3-benzothiazol-2-ylsulfanyl)ethanamide Openeye Name: N-[5-(1-adamantyl)thiazol-2-yl]-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide CAS Name: N-[5-(1-adamantyl)-2-thiazolyl]-2-(1,3-benzothiazol-2-ylthio)acetamide IUPAC Name: N-[5-(1-adamantyl)-1,3-thiazol-2-yl]-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide Traditional Name: N-[5-(1-adamantyl)thiazol-2-yl]-2-(1,3-benzothiazol-2-ylthio)acetamide Formula: C22H23N3OS3 MolecularWeight: 441.63252

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CN=C(S4)NC(=O)CSC5=NC6=CC=CC=C6S5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CN=C(S4)NC(=O)CSC5=NC6=CC=CC=C6S5

InChI

InChI=1S/C22H23N3OS3/c26-19(12-27-21-24-16-3-1-2-4-17(16)28-21)25-20-23-11-18(29-20)22-8-13-5-14(9-22)7-15(6-13)10-22/h1-4,11,13-15H,5-10,12H2,(H,23,25,26)