N-[3-methyl-1-oxidanylidene-1-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[2-methyl-1-[(5-propyl-1,3,4-thiadiazol-2-yl)carbamoyl]propyl]adamantane-1-carboxamide CAS Name: N-[3-methyl-1-oxo-1-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]butan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]butan-2-yl]adamantane-1-carboxamide Traditional Name: N-[2-methyl-1-[(5-propyl-1,3,4-thiadiazol-2-yl)carbamoyl]propyl]adamantane-1-carboxamide Formula: C21H32N4O2S MolecularWeight: 404.56938

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C(C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)C(C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H32N4O2S/c1-4-5-16-24-25-20(28-16)23-18(26)17(12(2)3)22-19(27)21-9-13-6-14(10-21)8-15(7-13)11-21/h12-15,17H,4-11H2,1-3H3,(H,22,27)(H,23,25,26)