2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-ethylpiperidin-4-yl)ethanamide

Systemtic Name: 2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-ethylpiperidin-4-yl)ethanamide Openeye Name: 2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-ethyl-4-piperidyl)acetamide CAS Name: 2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(1-ethyl-4-piperidinyl)acetamide IUPAC Name: 2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-ethylpiperidin-4-yl)acetamide Traditional Name: 2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(1-ethyl-4-piperidyl)acetamide Formula: C23H36N6OS MolecularWeight: 444.63654

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)NC(=O)CSC2=NN=C(N2CC)C3=CC=C(C=C3)N(CC)CC

Isomeric SMILES

CCN1CCC(CC1)NC(=O)CSC2=NN=C(N2CC)C3=CC=C(C=C3)N(CC)CC

InChI

InChI=1S/C23H36N6OS/c1-5-27-15-13-19(14-16-27)24-21(30)17-31-23-26-25-22(29(23)8-4)18-9-11-20(12-10-18)28(6-2)7-3/h9-12,19H,5-8,13-17H2,1-4H3,(H,24,30)