3-azanyl-5-methyl-1,2,3-triazolidin-4-one; N-[1-ethyl-4-(methoxymethyl)piperidin-4-yl]-N-phenyl-propanamide

Systemtic Name: 3-azanyl-5-methyl-1,2,3-triazolidin-4-one; N-[1-ethyl-4-(methoxymethyl)piperidin-4-yl]-N-phenyl-propanamide Openeye Name: 3-amino-5-methyl-triazolidin-4-one; N-[1-ethyl-4-(methoxymethyl)-4-piperidyl]-N-phenyl-propanamide CAS Name: 3-amino-5-methyl-4-triazolidinone; N-[1-ethyl-4-(methoxymethyl)-4-piperidinyl]-N-phenylpropanamide IUPAC Name: 3-amino-5-methyltriazolidin-4-one; N-[1-ethyl-4-(methoxymethyl)piperidin-4-yl]-N-phenylpropanamide Traditional Name: 3-amino-5-methyl-triazolidin-4-one; N-[1-ethyl-4-(methoxymethyl)-4-piperidyl]-N-phenyl-propionamide Formula: C21H36N6O3 MolecularWeight: 420.54894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CC)COC.CC1C(=O)N(NN1)N

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CC)COC.CC1C(=O)N(NN1)N

InChI

InChI=1S/C18H28N2O2.C3H8N4O/c1-4-17(21)20(16-9-7-6-8-10-16)18(15-22-3)11-13-19(5-2)14-12-18;1-2-3(8)7(4)6-5-2/h6-10H,4-5,11-15H2,1-3H3;2,5-6H,4H2,1H3