N-(2,5-dimethylphenyl)-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-(quinazolin-4-ylthio)acetamide Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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