N-(furan-2-ylmethyl)-6-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]hexanamide

Systemtic Name: N-(furan-2-ylmethyl)-6-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]hexanamide Openeye Name: N-(2-furylmethyl)-6-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]hexanamide CAS Name: N-(2-furanylmethyl)-6-[2-[(3-nitrophenyl)methylthio]-4-oxo-3-quinazolinyl]hexanamide IUPAC Name: N-(furan-2-ylmethyl)-6-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]hexanamide Traditional Name: N-(2-furfuryl)-6-[4-keto-2-[(3-nitrobenzyl)thio]quinazolin-3-yl]hexanamide Formula: C26H26N4O5S MolecularWeight: 506.57344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)[N+](=O)[O-])CCCCCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)[N+](=O)[O-])CCCCCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C26H26N4O5S/c31-24(27-17-21-10-7-15-35-21)13-2-1-5-14-29-25(32)22-11-3-4-12-23(22)28-26(29)36-18-19-8-6-9-20(16-19)30(33)34/h3-4,6-12,15-16H,1-2,5,13-14,17-18H2,(H,27,31)