1,3-dimethyl-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1,3-dimethyl-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1,3-dimethyl-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethylene)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1,3-dimethyl-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1,3-dimethyl-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1,3-dimethyl-5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethylene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CNC3=C2C=CC=N3)C(=O)N(C1=S)C

Isomeric SMILES

CN1C(=O)C(=CC2=CNC3=C2C=CC=N3)C(=O)N(C1=S)C

InChI

InChI=1S/C14H12N4O2S/c1-17-12(19)10(13(20)18(2)14(17)21)6-8-7-16-11-9(8)4-3-5-15-11/h3-7H,1-2H3,(H,15,16)