1-[3-(furan-2-ylmethyl)-4-oxidanylidene-2-phenacylsulfanyl-quinazolin-7-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[3-(furan-2-ylmethyl)-4-oxidanylidene-2-phenacylsulfanyl-quinazolin-7-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[3-(2-furylmethyl)-4-oxo-2-phenacylsulfanyl-quinazoline-7-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[3-(2-furanylmethyl)-4-oxo-2-(phenacylthio)-7-quinazolinyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-(furan-2-ylmethyl)-4-oxo-2-phenacylsulfanylquinazoline-7-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[3-(2-furfuryl)-4-keto-2-(phenacylthio)quinazoline-7-carbonyl]isonipecotamide Formula: C28H26N4O5S MolecularWeight: 530.59484

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC(=O)C4=CC=CC=C4)CC5=CC=CO5

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC(=O)C4=CC=CC=C4)CC5=CC=CO5

InChI

InChI=1S/C28H26N4O5S/c29-25(34)19-10-12-31(13-11-19)26(35)20-8-9-22-23(15-20)30-28(32(27(22)36)16-21-7-4-14-37-21)38-17-24(33)18-5-2-1-3-6-18/h1-9,14-15,19H,10-13,16-17H2,(H2,29,34)