(2S)-N-(2,5-dimethylphenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N-(2,5-dimethylphenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-propanamide Openeye Name: (2S)-N-(2,5-dimethylphenyl)-2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-propanamide CAS Name: (2S)-N-(2,5-dimethylphenyl)-2-[[2-(2-furanyl)-4-quinazolinyl]thio]propanamide IUPAC Name: (2S)-N-(2,5-dimethylphenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylpropanamide Traditional Name: (2S)-N-(2,5-dimethylphenyl)-2-[[2-(2-furyl)quinazolin-4-yl]thio]propionamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=NC(=NC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@H](C)SC2=NC(=NC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C23H21N3O2S/c1-14-10-11-15(2)19(13-14)25-22(27)16(3)29-23-17-7-4-5-8-18(17)24-21(26-23)20-9-6-12-28-20/h4-13,16H,1-3H3,(H,25,27)/t16-/m0/s1