2-[3-[(3-nitrophenyl)methyl]quinoxalin-2-yl]sulfanyl-N-(1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[3-[(3-nitrophenyl)methyl]quinoxalin-2-yl]sulfanyl-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[3-[(3-nitrophenyl)methyl]quinoxalin-2-yl]sulfanyl-N-thiazol-2-yl-acetamide CAS Name: 2-[[3-[(3-nitrophenyl)methyl]-2-quinoxalinyl]thio]-N-(2-thiazolyl)acetamide IUPAC Name: 2-[3-[(3-nitrophenyl)methyl]quinoxalin-2-yl]sulfanyl-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[[3-(3-nitrobenzyl)quinoxalin-2-yl]thio]-N-thiazol-2-yl-acetamide Formula: C20H15N5O3S2 MolecularWeight: 437.4948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)SCC(=O)NC3=NC=CS3)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)SCC(=O)NC3=NC=CS3)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O3S2/c26-18(24-20-21-8-9-29-20)12-30-19-17(22-15-6-1-2-7-16(15)23-19)11-13-4-3-5-14(10-13)25(27)28/h1-10H,11-12H2,(H,21,24,26)