S-[(4-bromophenyl)amino] N-(2-indolo[3,2-b]quinoxalin-6-ylethanoylamino)carbamothioate

Systemtic Name: S-[(4-bromophenyl)amino] N-(2-indolo[3,2-b]quinoxalin-6-ylethanoylamino)carbamothioate Openeye Name: S-(4-bromoanilino) N-[(2-indolo[3,2-b]quinoxalin-6-ylacetyl)amino]carbamothioate CAS Name: N-[[2-(6-indolo[3,2-b]quinoxalinyl)-1-oxoethyl]amino]carbamothioic acid S-(4-bromoanilino) ester IUPAC Name: S-(4-bromoanilino) N-[(2-indolo[3,2-b]quinoxalin-6-ylacetyl)amino]carbamothioate Traditional Name: N-[(2-indolo[3,2-b]quinoxalin-6-ylacetyl)amino]thiocarbamic acid S-(4-bromoanilino) ester Formula: C23H17BrN6O2S MolecularWeight: 521.38908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=NC4=CC=CC=C4N=C3N2CC(=O)NNC(=O)SNC5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C2C(=C1)C3=NC4=CC=CC=C4N=C3N2CC(=O)NNC(=O)SNC5=CC=C(C=C5)Br

InChI

InChI=1S/C23H17BrN6O2S/c24-14-9-11-15(12-10-14)29-33-23(32)28-27-20(31)13-30-19-8-4-1-5-16(19)21-22(30)26-18-7-3-2-6-17(18)25-21/h1-12,29H,13H2,(H,27,31)(H,28,32)