N-(1-adamantylcarbamoyl)-3-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-3-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(1-adamantylcarbamoyl)-3-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-3-(2-pyrimidinylthio)propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-3-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(1-adamantylcarbamoyl)-3-(2-pyrimidylthio)propionamide Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CCSC4=NC=CC=N4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CCSC4=NC=CC=N4

InChI

InChI=1S/C18H24N4O2S/c23-15(2-5-25-17-19-3-1-4-20-17)21-16(24)22-18-9-12-6-13(10-18)8-14(7-12)11-18/h1,3-4,12-14H,2,5-11H2,(H2,21,22,23,24)