2-[(3-bromophenyl)methylsulfonylmethyl]-3-oxidanylidene-N-(thiophen-2-ylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-3-oxidanylidene-N-(thiophen-2-ylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-3-oxo-N-(2-thienylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-3-oxo-N-(thiophen-2-ylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(3-bromophenyl)methylsulfonylmethyl]-3-oxo-N-(thiophen-2-ylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[(3-bromobenzyl)sulfonylmethyl]-3-keto-N-(2-thenyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C22H20BrN3O4S2 MolecularWeight: 534.4459

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CS(=O)(=O)CC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)NCC4=CC=CS4

Isomeric SMILES

C1=CC(=CC(=C1)Br)CS(=O)(=O)CC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C22H20BrN3O4S2/c23-16-4-1-3-14(9-16)12-32(29,30)13-20-22(28)26-19-10-15(6-7-18(19)25-20)21(27)24-11-17-5-2-8-31-17/h1-10,20,25H,11-13H2,(H,24,27)(H,26,28)