N-[4-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[4-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[3-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-1-methyl-3-oxo-propyl]benzamide CAS Name: N-[4-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxobutan-2-yl]benzamide IUPAC Name: N-[4-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-4-oxobutan-2-yl]benzamide Traditional Name: N-[3-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-3-keto-1-methyl-propyl]benzamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=NN=C(S1)C23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CC(CC(=O)NC1=NN=C(S1)C23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C23H28N4O2S/c1-14(24-20(29)18-5-3-2-4-6-18)7-19(28)25-22-27-26-21(30-22)23-11-15-8-16(12-23)10-17(9-15)13-23/h2-6,14-17H,7-13H2,1H3,(H,24,29)(H,25,27,28)