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

Systemtic Name: (2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: (2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: (2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-(4-quinazolinylthio)acetamide IUPAC Name: (2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-quinazolin-4-ylsulfanylacetamide Traditional Name: (2S)-N-(2,5-dimethylphenyl)-2-phenyl-2-(quinazolin-4-ylthio)acetamide Formula: C24H21N3OS MolecularWeight: 399.50804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC=NC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@H](C2=CC=CC=C2)SC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C24H21N3OS/c1-16-12-13-17(2)21(14-16)27-23(28)22(18-8-4-3-5-9-18)29-24-19-10-6-7-11-20(19)25-15-26-24/h3-15,22H,1-2H3,(H,27,28)/t22-/m0/s1