2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-N-(oxolan-2-ylmethyl)-3-prop-2-enyl-quinazoline-7-carboxamide

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-N-(oxolan-2-ylmethyl)-3-prop-2-enyl-quinazoline-7-carboxamide Openeye Name: 3-allyl-2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-4-oxo-N-(tetrahydrofuran-2-ylmethyl)quinazoline-7-carboxamide CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-4-oxo-N-(2-oxolanylmethyl)-3-prop-2-enyl-7-quinazolinecarboxamide IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-4-oxo-N-(oxolan-2-ylmethyl)-3-prop-2-enylquinazoline-7-carboxamide Traditional Name: 3-allyl-2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-4-keto-N-(tetrahydrofurfuryl)quinazoline-7-carboxamide Formula: C25H24BrN3O4S MolecularWeight: 542.44476

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3CCCO3)N=C1SCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3CCCO3)N=C1SCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H24BrN3O4S/c1-2-11-29-24(32)20-10-7-17(23(31)27-14-19-4-3-12-33-19)13-21(20)28-25(29)34-15-22(30)16-5-8-18(26)9-6-16/h2,5-10,13,19H,1,3-4,11-12,14-15H2,(H,27,31)