N-[4-(1-adamantyl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-(1-adamantyl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[4-(1-adamantyl)phenyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[4-(1-adamantyl)phenyl]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C24H29N3OS MolecularWeight: 407.57156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C24H29N3OS/c1-15-7-16(2)26-23(25-15)29-14-22(28)27-21-5-3-20(4-6-21)24-11-17-8-18(12-24)10-19(9-17)13-24/h3-7,17-19H,8-14H2,1-2H3,(H,27,28)