diethyl 2-[[4-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)sulfonylamino]phenyl]carbonylamino]pentanedioate

Systemtic Name: diethyl 2-[[4-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)sulfonylamino]phenyl]carbonylamino]pentanedioate Openeye Name: diethyl 2-[[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)sulfonylamino]benzoyl]amino]pentanedioate CAS Name: 2-[[[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)sulfonylamino]phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)sulfonylamino]benzoyl]amino]pentanedioate Traditional Name: 2-[[4-[(1-keto-3-methyl-4H-benzo[f]quinazolin-9-yl)sulfonylamino]benzoyl]amino]glutaric acid diethyl ester Formula: C29H30N4O8S MolecularWeight: 594.6355

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)C=CC4=C3C(=O)N=C(N4)C

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)C=CC4=C3C(=O)N=C(N4)C

InChI

InChI=1S/C29H30N4O8S/c1-4-40-25(34)15-14-24(29(37)41-5-2)32-27(35)19-6-10-20(11-7-19)33-42(38,39)21-12-8-18-9-13-23-26(22(18)16-21)28(36)31-17(3)30-23/h6-13,16,24,33H,4-5,14-15H2,1-3H3,(H,32,35)(H,30,31,36)