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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NC=CC=N4

Isomeric SMILES

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NC=CC=N4

InChI

InChI=1S/C18H24N4O2S/c1-11(25-17-19-3-2-4-20-17)15(23)21-16(24)22-18-8-12-5-13(9-18)7-14(6-12)10-18/h2-4,11-14H,5-10H2,1H3,(H2,21,22,23,24)