3-[5-[2-(1-adamantyl)ethylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-[2-(1-adamantyl)ethylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[2-(1-adamantyl)ethylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[2-(1-adamantyl)ethylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[2-(1-adamantyl)ethylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[2-(1-adamantyl)ethylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]propionamide Formula: C20H30N4OS MolecularWeight: 374.5434

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCCC34CC5CC(C3)CC(C5)C4)CCC(=O)N

Isomeric SMILES

C1CC1N2C(=NN=C2SCCC34CC5CC(C3)CC(C5)C4)CCC(=O)N

InChI

InChI=1S/C20H30N4OS/c21-17(25)3-4-18-22-23-19(24(18)16-1-2-16)26-6-5-20-10-13-7-14(11-20)9-15(8-13)12-20/h13-16H,1-12H2,(H2,21,25)