2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethanone

Systemtic Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethanone Openeye Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone CAS Name: 2-[[4-(cyclopropylamino)-2-quinazolinyl]thio]-1-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]ethanone IUPAC Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone Traditional Name: 2-[[4-(cyclopropylamino)quinazolin-2-yl]thio]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)CSC3=NC4=CC=CC=C4C(=N3)NC5CC5

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)CSC3=NC4=CC=CC=C4C(=N3)NC5CC5

InChI

InChI=1S/C22H23N5O2S/c28-19(14-11-18(23-12-14)21(29)27-9-3-4-10-27)13-30-22-25-17-6-2-1-5-16(17)20(26-22)24-15-7-8-15/h1-2,5-6,11-12,15,23H,3-4,7-10,13H2,(H,24,25,26)