4-oxidanylidene-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-N-(pyridin-2-ylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 4-oxidanylidene-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-N-(pyridin-2-ylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-N-(2-pyridylmethyl)-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-3-[3-(2-oxo-1-pyrrolidinyl)propyl]-N-(2-pyridinylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-3-[3-(2-oxopyrrolidin-1-yl)propyl]-N-(pyridin-2-ylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-3-[3-(2-ketopyrrolidino)propyl]-N-(2-pyridylmethyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCN2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CC=N4)NC2=S

Isomeric SMILES

C1CC(=O)N(C1)CCCN2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CC=N4)NC2=S

InChI

InChI=1S/C22H23N5O3S/c28-19-6-3-10-26(19)11-4-12-27-21(30)17-8-7-15(13-18(17)25-22(27)31)20(29)24-14-16-5-1-2-9-23-16/h1-2,5,7-9,13H,3-4,6,10-12,14H2,(H,24,29)(H,25,31)