2-[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-(1-adamantylmethylamino)-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-(1-adamantylmethylamino)-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-(1-adamantylmethylamino)-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-(1-adamantylmethylamino)-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H29N3O3S/c1-12-3-17(23-26-12)22-19(25)13(2)27-10-18(24)21-11-20-7-14-4-15(8-20)6-16(5-14)9-20/h3,13-16H,4-11H2,1-2H3,(H,21,24)(H,22,23,25)