2-[(4-tert-butylphenyl)methylsulfanyl]-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-N-(3-morpholinopropyl)pyridine-3-carboxamide CAS Name: 2-[(4-tert-butylphenyl)methylthio]-N-[3-(4-morpholinyl)propyl]-3-pyridinecarboxamide IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide Traditional Name: 2-[(4-tert-butylbenzyl)thio]-N-(3-morpholinopropyl)nicotinamide Formula: C24H33N3O2S MolecularWeight: 427.60272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=C(C=CC=N2)C(=O)NCCCN3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=C(C=CC=N2)C(=O)NCCCN3CCOCC3

InChI

InChI=1S/C24H33N3O2S/c1-24(2,3)20-9-7-19(8-10-20)18-30-23-21(6-4-11-26-23)22(28)25-12-5-13-27-14-16-29-17-15-27/h4,6-11H,5,12-18H2,1-3H3,(H,25,28)