N-(2,6-dimethylphenyl)-2-[3-(2,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[3-(2,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[3-(2,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(2,6-dimethylphenyl)-2-[[3-(2,4-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[3-(2,4-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(2,6-dimethylphenyl)-2-[[3-(2,4-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=C(C=CC=C4C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=C(C=CC=C4C)C)C

InChI

InChI=1S/C27H27N3O2S/c1-16-13-14-23(19(4)15-16)30-26(32)21-11-6-7-12-22(21)28-27(30)33-20(5)25(31)29-24-17(2)9-8-10-18(24)3/h6-15,20H,1-5H3,(H,29,31)