3,3-dimethyl-4-[(2S)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylpropanoyl]-1H-quinoxalin-2-one

Systemtic Name: 3,3-dimethyl-4-[(2S)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylpropanoyl]-1H-quinoxalin-2-one Openeye Name: 3,3-dimethyl-4-[(2S)-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanylpropanoyl]-1H-quinoxalin-2-one CAS Name: 3,3-dimethyl-4-[(2S)-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]-1-oxopropyl]-1H-quinoxalin-2-one IUPAC Name: 3,3-dimethyl-4-[(2S)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylpropanoyl]-1H-quinoxalin-2-one Traditional Name: 3,3-dimethyl-4-[(2S)-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]propanoyl]-1H-quinoxalin-2-one Formula: C26H29N5O3S MolecularWeight: 491.60516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NC(=NC4=CC=CC=C43)CN5CCOCC5

Isomeric SMILES

C[C@@H](C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=NC(=NC4=CC=CC=C43)CN5CCOCC5

InChI

InChI=1S/C26H29N5O3S/c1-17(24(32)31-21-11-7-6-10-20(21)28-25(33)26(31,2)3)35-23-18-8-4-5-9-19(18)27-22(29-23)16-30-12-14-34-15-13-30/h4-11,17H,12-16H2,1-3H3,(H,28,33)/t17-/m0/s1