1-(2,5-dimethylphenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanone

Systemtic Name: 1-(2,5-dimethylphenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanone Openeye Name: 1-(2,5-dimethylphenyl)-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-ethanone CAS Name: 1-(2,5-dimethylphenyl)-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]ethanone IUPAC Name: 1-(2,5-dimethylphenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylethanone Traditional Name: 1-(2,5-dimethylphenyl)-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]ethanone Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CSC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CSC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

InChI

InChI=1S/C23H25N3O2S/c1-16-7-8-17(2)19(13-16)21(27)15-29-23-18-5-3-4-6-20(18)24-22(25-23)14-26-9-11-28-12-10-26/h3-8,13H,9-12,14-15H2,1-2H3