2-[[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]amino]quinazoline-6-carbonitrile

Systemtic Name: 2-[[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]amino]quinazoline-6-carbonitrile Openeye Name: 2-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]quinazoline-6-carbonitrile CAS Name: 2-[3-[(2-oxo-1-pyrrolidinyl)methyl]anilino]-6-quinazolinecarbonitrile IUPAC Name: 2-[3-[(2-oxopyrrolidin-1-yl)methyl]anilino]quinazoline-6-carbonitrile Traditional Name: 2-[3-[(2-ketopyrrolidino)methyl]anilino]quinazoline-6-carbonitrile Formula: C20H17N5O MolecularWeight: 343.38188

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC(=CC=C2)NC3=NC=C4C=C(C=CC4=N3)C#N

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC(=CC=C2)NC3=NC=C4C=C(C=CC4=N3)C#N

InChI

InChI=1S/C20H17N5O/c21-11-14-6-7-18-16(9-14)12-22-20(24-18)23-17-4-1-3-15(10-17)13-25-8-2-5-19(25)26/h1,3-4,6-7,9-10,12H,2,5,8,13H2,(H,22,23,24)