3-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-1-[[7-chloranyl-2,4-bis(oxidanylidene)-1H-quinazolin-6-yl]methyl]-5-ethyl-6-fluoranyl-N-methylsulfonyl-indole-2-carboxamide

Systemtic Name: 3-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-1-[[7-chloranyl-2,4-bis(oxidanylidene)-1H-quinazolin-6-yl]methyl]-5-ethyl-6-fluoranyl-N-methylsulfonyl-indole-2-carboxamide Openeye Name: 1-[(7-chloro-2,4-dioxo-1H-quinazolin-6-yl)methyl]-3-(2,4-dioxo-1H-quinazolin-3-yl)-5-ethyl-6-fluoro-N-methylsulfonyl-indole-2-carboxamide CAS Name: 1-[(7-chloro-2,4-dioxo-1H-quinazolin-6-yl)methyl]-3-(2,4-dioxo-1H-quinazolin-3-yl)-5-ethyl-6-fluoro-N-methylsulfonyl-2-indolecarboxamide IUPAC Name: 1-[(7-chloro-2,4-dioxo-1H-quinazolin-6-yl)methyl]-3-(2,4-dioxo-1H-quinazolin-3-yl)-5-ethyl-6-fluoro-N-methylsulfonylindole-2-carboxamide Traditional Name: 1-[(7-chloro-2,4-diketo-1H-quinazolin-6-yl)methyl]-3-(2,4-diketo-1H-quinazolin-3-yl)-5-ethyl-6-fluoro-N-mesyl-indole-2-carboxamide Formula: C29H22ClFN6O7S MolecularWeight: 653.037383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=C(N2CC3=C(C=C4C(=C3)C(=O)NC(=O)N4)Cl)C(=O)NS(=O)(=O)C)N5C(=O)C6=CC=CC=C6NC5=O)F

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=C(N2CC3=C(C=C4C(=C3)C(=O)NC(=O)N4)Cl)C(=O)NS(=O)(=O)C)N5C(=O)C6=CC=CC=C6NC5=O)F

InChI

InChI=1S/C29H22ClFN6O7S/c1-3-13-8-17-22(11-19(13)31)36(12-14-9-16-21(10-18(14)30)32-28(41)34-25(16)38)24(26(39)35-45(2,43)44)23(17)37-27(40)15-6-4-5-7-20(15)33-29(37)42/h4-11H,3,12H2,1-2H3,(H,33,42)(H,35,39)(H2,32,34,38,41)