3-(1-methylpyrazol-4-yl)-10,10-bis(oxidanylidene)thioxanthen-9-one

Systemtic Name: 3-(1-methylpyrazol-4-yl)-10,10-bis(oxidanylidene)thioxanthen-9-one Openeye Name: 3-(1-methylpyrazol-4-yl)-10,10-dioxo-thioxanthen-9-one CAS Name: 3-(1-methyl-4-pyrazolyl)-10,10-dioxo-9-thioxanthenone IUPAC Name: 3-(1-methylpyrazol-4-yl)-10,10-dioxothioxanthen-9-one Traditional Name: 10,10-diketo-3-(1-methylpyrazol-4-yl)thioxanthen-9-one Formula: C17H12N2O3S MolecularWeight: 324.35378

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CN1C=C(C=N1)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C17H12N2O3S/c1-19-10-12(9-18-19)11-6-7-14-16(8-11)23(21,22)15-5-3-2-4-13(15)17(14)20/h2-10H,1H3