6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)hexanamide

Systemtic Name: 6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)hexanamide Openeye Name: 6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)hexanamide CAS Name: 6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]hexanamide IUPAC Name: 6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)hexanamide Traditional Name: 6-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-(2-phenyl-2-pyrrolidino-ethyl)hexanamide Formula: C26H32N4O2S MolecularWeight: 464.62288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S)C4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2S/c31-24(27-19-23(29-16-9-10-17-29)20-11-3-1-4-12-20)15-5-2-8-18-30-25(32)21-13-6-7-14-22(21)28-26(30)33/h1,3-4,6-7,11-14,23H,2,5,8-10,15-19H2,(H,27,31)(H,28,33)