N-ethyl-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide

Systemtic Name: N-ethyl-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide Openeye Name: N-ethyl-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide CAS Name: N-ethyl-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-1-adamantanecarboxamide IUPAC Name: N-ethyl-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide Traditional Name: N-ethyl-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NN=C(S1)C2=CC=C(C=C2)OC)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN(C1=NN=C(S1)C2=CC=C(C=C2)OC)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3O2S/c1-3-25(20(26)22-11-14-8-15(12-22)10-16(9-14)13-22)21-24-23-19(28-21)17-4-6-18(27-2)7-5-17/h4-7,14-16H,3,8-13H2,1-2H3