N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-methyl-but-2-enamide

Systemtic Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-methyl-but-2-enamide Openeye Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-methyl-but-2-enamide CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-butenamide IUPAC Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-methylbut-2-enamide Traditional Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-3-methyl-but-2-enamide Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=NN=C(S1)C23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CC(=CC(=O)NC1=NN=C(S1)C23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C17H23N3OS/c1-10(2)3-14(21)18-16-20-19-15(22-16)17-7-11-4-12(8-17)6-13(5-11)9-17/h3,11-13H,4-9H2,1-2H3,(H,18,20,21)