3-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-(4-tert-butylphenyl)thiophene-2-carboxamide

Systemtic Name: 3-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-(4-tert-butylphenyl)thiophene-2-carboxamide Openeye Name: 3-[(2-acetamido-4-pyridyl)methylsulfanyl]-N-(4-tert-butylphenyl)thiophene-2-carboxamide CAS Name: 3-[(2-acetamido-4-pyridinyl)methylthio]-N-(4-tert-butylphenyl)-2-thiophenecarboxamide IUPAC Name: 3-[(2-acetamidopyridin-4-yl)methylsulfanyl]-N-(4-tert-butylphenyl)thiophene-2-carboxamide Traditional Name: 3-[(2-acetamido-4-pyridyl)methylthio]-N-(4-tert-butylphenyl)thiophene-2-carboxamide Formula: C23H25N3O2S2 MolecularWeight: 439.5935

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=CC(=C1)CSC2=C(SC=C2)C(=O)NC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(=O)NC1=NC=CC(=C1)CSC2=C(SC=C2)C(=O)NC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H25N3O2S2/c1-15(27)25-20-13-16(9-11-24-20)14-30-19-10-12-29-21(19)22(28)26-18-7-5-17(6-8-18)23(2,3)4/h5-13H,14H2,1-4H3,(H,26,28)(H,24,25,27)