2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[4-(cyclopropylamino)-2-quinazolinyl]thio]-N-[oxo-(prop-2-enylamino)methyl]acetamide IUPAC Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[[4-(cyclopropylamino)quinazolin-2-yl]thio]acetamide Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=N1)NC3CC3

Isomeric SMILES

C=CCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=N1)NC3CC3

InChI

InChI=1S/C17H19N5O2S/c1-2-9-18-16(24)21-14(23)10-25-17-20-13-6-4-3-5-12(13)15(22-17)19-11-7-8-11/h2-6,11H,1,7-10H2,(H,19,20,22)(H2,18,21,23,24)