N-(2,6-dimethylphenyl)-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(2,6-dimethylphenyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(2,6-dimethylphenyl)-2-(quinazolin-4-ylthio)acetamide Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C18H17N3OS/c1-12-6-5-7-13(2)17(12)21-16(22)10-23-18-14-8-3-4-9-15(14)19-11-20-18/h3-9,11H,10H2,1-2H3,(H,21,22)