2-(1-adamantylsulfanyl)-N-(pyrimidin-4-ylmethyl)ethanamide

Systemtic Name: 2-(1-adamantylsulfanyl)-N-(pyrimidin-4-ylmethyl)ethanamide Openeye Name: 2-(1-adamantylsulfanyl)-N-(pyrimidin-4-ylmethyl)acetamide CAS Name: 2-(1-adamantylthio)-N-(4-pyrimidinylmethyl)acetamide IUPAC Name: 2-(1-adamantylsulfanyl)-N-(pyrimidin-4-ylmethyl)acetamide Traditional Name: 2-(1-adamantylthio)-N-(4-pyrimidylmethyl)acetamide Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)SCC(=O)NCC4=NC=NC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)SCC(=O)NCC4=NC=NC=C4

InChI

InChI=1S/C17H23N3OS/c21-16(19-9-15-1-2-18-11-20-15)10-22-17-6-12-3-13(7-17)5-14(4-12)8-17/h1-2,11-14H,3-10H2,(H,19,21)