2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-1-(1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-[[4-(cyclopropylamino)-2-quinazolinyl]thio]-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-[[4-(cyclopropylamino)quinazolin-2-yl]thio]-1-(1H-pyrrol-2-yl)ethanone Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC3=CC=CC=C32)SCC(=O)C4=CC=CN4

Isomeric SMILES

C1CC1NC2=NC(=NC3=CC=CC=C32)SCC(=O)C4=CC=CN4

InChI

InChI=1S/C17H16N4OS/c22-15(14-6-3-9-18-14)10-23-17-20-13-5-2-1-4-12(13)16(21-17)19-11-7-8-11/h1-6,9,11,18H,7-8,10H2,(H,19,20,21)