N-(furan-2-ylmethyl)-2-[4-oxidanylidene-3-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[4-oxidanylidene-3-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-furylmethyl)-2-[4-oxo-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(2-furanylmethyl)-2-[[4-oxo-3-[4-oxo-4-(4-phenyl-1-piperazinyl)butyl]-2-quinazolinyl]thio]acetamide IUPAC Name: N-(furan-2-ylmethyl)-2-[4-oxo-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(2-furfuryl)-2-[[4-keto-3-[4-keto-4-(4-phenylpiperazino)butyl]quinazolin-2-yl]thio]acetamide Formula: C29H31N5O4S MolecularWeight: 545.65254

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCN3C(=O)C4=CC=CC=C4N=C3SCC(=O)NCC5=CC=CO5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCN3C(=O)C4=CC=CC=C4N=C3SCC(=O)NCC5=CC=CO5

InChI

InChI=1S/C29H31N5O4S/c35-26(30-20-23-10-7-19-38-23)21-39-29-31-25-12-5-4-11-24(25)28(37)34(29)14-6-13-27(36)33-17-15-32(16-18-33)22-8-2-1-3-9-22/h1-5,7-12,19H,6,13-18,20-21H2,(H,30,35)