N-(1-adamantyl)-2-[[5-(oxolan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide

Systemtic Name: N-(1-adamantyl)-2-[[5-(oxolan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Openeye Name: N-(1-adamantyl)-2-[[5-(tetrahydrofuran-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide CAS Name: N-(1-adamantyl)-2-[[5-(2-oxolanylmethylamino)-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: N-(1-adamantyl)-2-[[5-(oxolan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Traditional Name: N-(1-adamantyl)-2-[[5-(tetrahydrofurfurylamino)-1,3,4-thiadiazol-2-yl]thio]propionamide Formula: C20H30N4O2S2 MolecularWeight: 422.6078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NN=C(S4)NCC5CCCO5

Isomeric SMILES

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NN=C(S4)NCC5CCCO5

InChI

InChI=1S/C20H30N4O2S2/c1-12(27-19-24-23-18(28-19)21-11-16-3-2-4-26-16)17(25)22-20-8-13-5-14(9-20)7-15(6-13)10-20/h12-16H,2-11H2,1H3,(H,21,23)(H,22,25)