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

Systemtic Name: (2S)-1-(4-bromophenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-propan-1-one Openeye Name: (2S)-1-(4-bromophenyl)-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-propan-1-one CAS Name: (2S)-1-(4-bromophenyl)-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]-1-propanone IUPAC Name: (2S)-1-(4-bromophenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylpropan-1-one Traditional Name: (2S)-1-(4-bromophenyl)-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]propan-1-one Formula: C22H22BrN3O2S MolecularWeight: 472.39798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrN3O2S/c1-15(21(27)16-6-8-17(23)9-7-16)29-22-18-4-2-3-5-19(18)24-20(25-22)14-26-10-12-28-13-11-26/h2-9,15H,10-14H2,1H3/t15-/m0/s1