N-[5-[(3-oxidanylidene-4H-quinoxalin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: N-[5-[(3-oxidanylidene-4H-quinoxalin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-[5-[(3-oxo-4H-quinoxalin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-[5-[(3-oxo-4H-quinoxalin-2-yl)methylthio]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-[5-[(3-oxo-4H-quinoxalin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-[5-[(3-keto-4H-quinoxalin-2-yl)methylthio]-1,3,4-thiadiazol-2-yl]benzamide Formula: C18H13N5O2S2 MolecularWeight: 395.45812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C18H13N5O2S2/c24-15(11-6-2-1-3-7-11)21-17-22-23-18(27-17)26-10-14-16(25)20-13-9-5-4-8-12(13)19-14/h1-9H,10H2,(H,20,25)(H,21,22,24)