(2S)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-N-(phenylcarbamoyl)propanamide

Systemtic Name: (2S)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-N-(phenylcarbamoyl)propanamide Openeye Name: (2S)-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-N-(phenylcarbamoyl)propanamide CAS Name: (2S)-N-[anilino(oxo)methyl]-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]propanamide IUPAC Name: (2S)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-N-(phenylcarbamoyl)propanamide Traditional Name: (2S)-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]-N-(phenylcarbamoyl)propionamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC=CC=C1)SC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC1=CC=CC=C1)SC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

InChI

InChI=1S/C23H25N5O3S/c1-16(21(29)27-23(30)24-17-7-3-2-4-8-17)32-22-18-9-5-6-10-19(18)25-20(26-22)15-28-11-13-31-14-12-28/h2-10,16H,11-15H2,1H3,(H2,24,27,29,30)/t16-/m0/s1