N-(1-adamantyl)-2-quinolin-2-ylsulfanyl-propanamide

Systemtic Name: N-(1-adamantyl)-2-quinolin-2-ylsulfanyl-propanamide Openeye Name: N-(1-adamantyl)-2-(2-quinolylsulfanyl)propanamide CAS Name: N-(1-adamantyl)-2-(2-quinolinylthio)propanamide IUPAC Name: N-(1-adamantyl)-2-quinolin-2-ylsulfanylpropanamide Traditional Name: N-(1-adamantyl)-2-(2-quinolylthio)propionamide Formula: C22H26N2OS MolecularWeight: 366.51964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H26N2OS/c1-14(26-20-7-6-18-4-2-3-5-19(18)23-20)21(25)24-22-11-15-8-16(12-22)10-17(9-15)13-22/h2-7,14-17H,8-13H2,1H3,(H,24,25)