N-(4-tert-butylphenyl)-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(4-tert-butylphenyl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(4-tert-butylphenyl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(4-tert-butylphenyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(4-tert-butylphenyl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(4-tert-butylphenyl)-2-(quinazolin-4-ylthio)acetamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C20H21N3OS/c1-20(2,3)14-8-10-15(11-9-14)23-18(24)12-25-19-16-6-4-5-7-17(16)21-13-22-19/h4-11,13H,12H2,1-3H3,(H,23,24)