2-(1-adamantylcarbamoylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide

Systemtic Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide Openeye Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]amino]-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide IUPAC Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide Traditional Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propionamide Formula: C28H30FN5O2S MolecularWeight: 519.633503

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(CC4=CC=CC=C4)C(=O)NC5=NN=C(S5)C6=CC=C(C=C6)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(CC4=CC=CC=C4)C(=O)NC5=NN=C(S5)C6=CC=C(C=C6)F

InChI

InChI=1S/C28H30FN5O2S/c29-22-8-6-21(7-9-22)25-33-34-27(37-25)31-24(35)23(13-17-4-2-1-3-5-17)30-26(36)32-28-14-18-10-19(15-28)12-20(11-18)16-28/h1-9,18-20,23H,10-16H2,(H2,30,32,36)(H,31,34,35)