(2S)-1-(4-methylphenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-propan-1-one

Systemtic Name: (2S)-1-(4-methylphenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-propan-1-one Openeye Name: (2S)-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-1-(p-tolyl)propan-1-one CAS Name: (2S)-1-(4-methylphenyl)-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]-1-propanone IUPAC Name: (2S)-1-(4-methylphenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylpropan-1-one Traditional Name: (2S)-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]-1-(p-tolyl)propan-1-one Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C)SC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

InChI

InChI=1S/C23H25N3O2S/c1-16-7-9-18(10-8-16)22(27)17(2)29-23-19-5-3-4-6-20(19)24-21(25-23)15-26-11-13-28-14-12-26/h3-10,17H,11-15H2,1-2H3/t17-/m0/s1