2-[(4-nitrophenyl)methylsulfanyl]-4-oxidanylidene-3-(oxolan-2-ylmethyl)-N-propyl-quinazoline-7-carboxamide

Systemtic Name: 2-[(4-nitrophenyl)methylsulfanyl]-4-oxidanylidene-3-(oxolan-2-ylmethyl)-N-propyl-quinazoline-7-carboxamide Openeye Name: 2-[(4-nitrophenyl)methylsulfanyl]-4-oxo-N-propyl-3-(tetrahydrofuran-2-ylmethyl)quinazoline-7-carboxamide CAS Name: 2-[(4-nitrophenyl)methylthio]-4-oxo-3-(2-oxolanylmethyl)-N-propyl-7-quinazolinecarboxamide IUPAC Name: 2-[(4-nitrophenyl)methylsulfanyl]-4-oxo-3-(oxolan-2-ylmethyl)-N-propylquinazoline-7-carboxamide Traditional Name: 4-keto-2-[(4-nitrobenzyl)thio]-N-propyl-3-(tetrahydrofurfuryl)quinazoline-7-carboxamide Formula: C24H26N4O5S MolecularWeight: 482.55204

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-])CC4CCCO4

Isomeric SMILES

CCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-])CC4CCCO4

InChI

InChI=1S/C24H26N4O5S/c1-2-11-25-22(29)17-7-10-20-21(13-17)26-24(27(23(20)30)14-19-4-3-12-33-19)34-15-16-5-8-18(9-6-16)28(31)32/h5-10,13,19H,2-4,11-12,14-15H2,1H3,(H,25,29)