N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(9,10-dioxo-2-anthryl)-2-(1-methyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(9,10-dioxo-2-anthracenyl)-2-[(1-methyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(9,10-dioxoanthracen-2-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(9,10-diketo-2-anthryl)-2-[(1-methyltetrazol-5-yl)thio]acetamide Formula: C18H13N5O3S MolecularWeight: 379.39252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN1C(=NN=N1)SCC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C18H13N5O3S/c1-23-18(20-21-22-23)27-9-15(24)19-10-6-7-13-14(8-10)17(26)12-5-3-2-4-11(12)16(13)25/h2-8H,9H2,1H3,(H,19,24)