(2S)-2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide

Systemtic Name: (2S)-2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide Openeye Name: (2S)-2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide CAS Name: (2S)-2-[[4-(cyclopropylamino)-2-quinazolinyl]thio]-N-(methylcarbamoyl)propanamide IUPAC Name: (2S)-2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide Traditional Name: (2S)-2-[[4-(cyclopropylamino)quinazolin-2-yl]thio]-N-(methylcarbamoyl)propionamide Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)SC1=NC2=CC=CC=C2C(=N1)NC3CC3

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)SC1=NC2=CC=CC=C2C(=N1)NC3CC3

InChI

InChI=1S/C16H19N5O2S/c1-9(14(22)21-15(23)17-2)24-16-19-12-6-4-3-5-11(12)13(20-16)18-10-7-8-10/h3-6,9-10H,7-8H2,1-2H3,(H,18,19,20)(H2,17,21,22,23)/t9-/m0/s1