2-(1-adamantylcarbamoylamino)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide

Systemtic Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide Openeye Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]amino]-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methylpentanamide IUPAC Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methylpentanamide Traditional Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-valeramide Formula: C27H38N6O2S MolecularWeight: 510.69462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)N(C)C)NC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)N(C)C)NC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H38N6O2S/c1-5-16(2)22(28-25(35)30-27-13-17-10-18(14-27)12-19(11-17)15-27)23(34)29-26-32-31-24(36-26)20-6-8-21(9-7-20)33(3)4/h6-9,16-19,22H,5,10-15H2,1-4H3,(H2,28,30,35)(H,29,32,34)