methyl 4-oxidanylidene-2-[2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]sulfanyl-3-(oxolan-2-ylmethyl)quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-[2-oxidanylidene-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]sulfanyl-3-(oxolan-2-ylmethyl)quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]sulfanyl-3-(tetrahydrofuran-2-ylmethyl)quinazoline-7-carboxylate CAS Name: 4-oxo-3-(2-oxolanylmethyl)-2-[[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]thio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 4-oxo-3-(oxolan-2-ylmethyl)-2-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]sulfanylquinazoline-7-carboxylate Traditional Name: 4-keto-2-[[2-keto-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl]thio]-3-(tetrahydrofurfuryl)quinazoline-7-carboxylic acid methyl ester Formula: C25H28N4O7S2 MolecularWeight: 560.64242

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)CC4CCCO4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)CC4CCCO4

InChI

InChI=1S/C25H28N4O7S2/c1-35-24(32)17-6-9-20-21(13-17)28-25(29(23(20)31)14-18-3-2-12-36-18)37-15-22(30)27-11-10-16-4-7-19(8-5-16)38(26,33)34/h4-9,13,18H,2-3,10-12,14-15H2,1H3,(H,27,30)(H2,26,33,34)