N1-(1-adamantyl)-N2-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]pyrrolidine-1,2-dicarboxamide

Systemtic Name: N1-(1-adamantyl)-N2-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]pyrrolidine-1,2-dicarboxamide Openeye Name: N1-(1-adamantyl)-N2-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]pyrrolidine-1,2-dicarboxamide CAS Name: N1-(1-adamantyl)-N2-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]pyrrolidine-1,2-dicarboxamide IUPAC Name: 1-N-(1-adamantyl)-2-N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]pyrrolidine-1,2-dicarboxamide Traditional Name: N-(1-adamantyl)-N'-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]pyrrolidine-1,2-dicarboxamide Formula: C25H29N5O4S MolecularWeight: 495.59386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)NC23CC4CC(C2)CC(C4)C3)C(=O)NC5=NN=C(S5)C6=CC7=C(C=C6)OCO7

Isomeric SMILES

C1CC(N(C1)C(=O)NC23CC4CC(C2)CC(C4)C3)C(=O)NC5=NN=C(S5)C6=CC7=C(C=C6)OCO7

InChI

InChI=1S/C25H29N5O4S/c31-21(26-23-29-28-22(35-23)17-3-4-19-20(9-17)34-13-33-19)18-2-1-5-30(18)24(32)27-25-10-14-6-15(11-25)8-16(7-14)12-25/h3-4,9,14-16,18H,1-2,5-8,10-13H2,(H,27,32)(H,26,29,31)