6-(2-ethanoyl-1,2,3,4-tetrazol-5-yl)-2-methyl-10,10-bis(oxidanylidene)thioxanthen-9-one

Systemtic Name: 6-(2-ethanoyl-1,2,3,4-tetrazol-5-yl)-2-methyl-10,10-bis(oxidanylidene)thioxanthen-9-one Openeye Name: 6-(2-acetyltetrazol-5-yl)-2-methyl-10,10-dioxo-thioxanthen-9-one CAS Name: 6-(2-acetyl-5-tetrazolyl)-2-methyl-10,10-dioxo-9-thioxanthenone IUPAC Name: 6-(2-acetyltetrazol-5-yl)-2-methyl-10,10-dioxothioxanthen-9-one Traditional Name: 6-(2-acetyltetrazol-5-yl)-10,10-diketo-2-methyl-thioxanthen-9-one Formula: C17H12N4O4S MolecularWeight: 368.36658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)S(=O)(=O)C3=C(C2=O)C=CC(=C3)C4=NN(N=N4)C(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)S(=O)(=O)C3=C(C2=O)C=CC(=C3)C4=NN(N=N4)C(=O)C

InChI

InChI=1S/C17H12N4O4S/c1-9-3-6-14-13(7-9)16(23)12-5-4-11(8-15(12)26(14,24)25)17-18-20-21(19-17)10(2)22/h3-8H,1-2H3