1-(1-adamantyl)-2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one

Systemtic Name: 1-(1-adamantyl)-2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Openeye Name: 1-(1-adamantyl)-2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one CAS Name: 1-(1-adamantyl)-2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]thio]-1-propanone IUPAC Name: 1-(1-adamantyl)-2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Traditional Name: 1-(1-adamantyl)-2-[[5-(2-methoxyethylamino)-1,3,4-thiadiazol-2-yl]thio]propan-1-one Formula: C18H27N3O2S2 MolecularWeight: 381.55588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C12CC3CC(C1)CC(C3)C2)SC4=NN=C(S4)NCCOC

Isomeric SMILES

CC(C(=O)C12CC3CC(C1)CC(C3)C2)SC4=NN=C(S4)NCCOC

InChI

InChI=1S/C18H27N3O2S2/c1-11(24-17-21-20-16(25-17)19-3-4-23-2)15(22)18-8-12-5-13(9-18)7-14(6-12)10-18/h11-14H,3-10H2,1-2H3,(H,19,20)