4-[4-oxidanylidene-2-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]sulfanyl-quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[4-oxidanylidene-2-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]sulfanyl-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[4-oxo-2-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]sulfanyl-quinazolin-3-yl]benzonitrile CAS Name: 4-[4-oxo-2-[[2-oxo-2-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]ethyl]thio]-3-quinazolinyl]benzonitrile IUPAC Name: 4-[4-oxo-2-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]sulfanylquinazolin-3-yl]benzonitrile Traditional Name: 4-[4-keto-2-[[2-keto-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]thio]quinazolin-3-yl]benzonitrile Formula: C26H21N5O3S MolecularWeight: 483.54164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H21N5O3S/c27-14-17-7-9-19(10-8-17)31-24(33)20-5-1-2-6-21(20)29-26(31)35-16-23(32)18-13-22(28-15-18)25(34)30-11-3-4-12-30/h1-2,5-10,13,15,28H,3-4,11-12,16H2