(2S)-N-(methylcarbamoyl)-2-[3-(3-morpholin-4-ylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N-(methylcarbamoyl)-2-[3-(3-morpholin-4-ylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2S)-N-(methylcarbamoyl)-2-[3-(3-morpholinopropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2S)-N-(methylcarbamoyl)-2-[[3-[3-(4-morpholinyl)propyl]-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2S)-N-(methylcarbamoyl)-2-[3-(3-morpholin-4-ylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2S)-2-[[4-keto-3-(3-morpholinopropyl)quinazolin-2-yl]thio]-N-(methylcarbamoyl)propionamide Formula: C20H27N5O4S MolecularWeight: 433.52448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)SC1=NC2=CC=CC=C2C(=O)N1CCCN3CCOCC3

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)SC1=NC2=CC=CC=C2C(=O)N1CCCN3CCOCC3

InChI

InChI=1S/C20H27N5O4S/c1-14(17(26)23-19(28)21-2)30-20-22-16-7-4-3-6-15(16)18(27)25(20)9-5-8-24-10-12-29-13-11-24/h3-4,6-7,14H,5,8-13H2,1-2H3,(H2,21,23,26,28)/t14-/m0/s1