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

Systemtic Name: 2-methoxy-6-(2-methyl-1,2,3,4-tetrazol-5-yl)-10,10-bis(oxidanylidene)thioxanthen-9-one Openeye Name: 2-methoxy-6-(2-methyltetrazol-5-yl)-10,10-dioxo-thioxanthen-9-one CAS Name: 2-methoxy-6-(2-methyl-5-tetrazolyl)-10,10-dioxo-9-thioxanthenone IUPAC Name: 2-methoxy-6-(2-methyltetrazol-5-yl)-10,10-dioxothioxanthen-9-one Traditional Name: 10,10-diketo-2-methoxy-6-(2-methyltetrazol-5-yl)thioxanthen-9-one Formula: C16H12N4O4S MolecularWeight: 356.35588

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Descriptors Computed from Structure

Canonical SMILES:

CN1N=C(N=N1)C2=CC3=C(C=C2)C(=O)C4=C(S3(=O)=O)C=CC(=C4)OC

Isomeric SMILES

CN1N=C(N=N1)C2=CC3=C(C=C2)C(=O)C4=C(S3(=O)=O)C=CC(=C4)OC

InChI

InChI=1S/C16H12N4O4S/c1-20-18-16(17-19-20)9-3-5-11-14(7-9)25(22,23)13-6-4-10(24-2)8-12(13)15(11)21/h3-8H,1-2H3