N-[4-oxidanylidene-4-[(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)amino]butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-oxidanylidene-4-[(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)amino]butyl]adamantane-1-carboxamide Openeye Name: N-[4-[[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-oxo-4-[(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)amino]butyl]-1-adamantanecarboxamide IUPAC Name: N-[4-oxo-4-[(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)amino]butyl]adamantane-1-carboxamide Traditional Name: N-[4-[[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]amino]-4-keto-butyl]adamantane-1-carboxamide Formula: C22H34N4O2S MolecularWeight: 418.59596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H34N4O2S/c1-3-17(4-2)19-25-26-21(29-19)24-18(27)6-5-7-23-20(28)22-11-14-8-15(12-22)10-16(9-14)13-22/h14-17H,3-13H2,1-2H3,(H,23,28)(H,24,26,27)