4-(1H-pyrimidin-2-ylidene)-2-(thiomorpholin-4-ium-4-ylmethyl)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(1H-pyrimidin-2-ylidene)-2-(thiomorpholin-4-ium-4-ylmethyl)cyclohexa-2,5-dien-1-one Openeye Name: 4-(1H-pyrimidin-2-ylidene)-2-(thiomorpholin-4-ium-4-ylmethyl)cyclohexa-2,5-dien-1-one CAS Name: 4-(1H-pyrimidin-2-ylidene)-2-(4-thiomorpholin-4-iumylmethyl)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(1H-pyrimidin-2-ylidene)-2-(thiomorpholin-4-ium-4-ylmethyl)cyclohexa-2,5-dien-1-one Traditional Name: 4-(1H-pyrimidin-2-ylidene)-2-(thiomorpholin-4-ium-4-ylmethyl)cyclohexa-2,5-dien-1-one Formula: C15H18N3OS+ MolecularWeight: 288.38792

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC[NH+]1CC2=CC(=C3NC=CC=N3)C=CC2=O

Isomeric SMILES

C1CSCC[NH+]1CC2=CC(=C3NC=CC=N3)C=CC2=O

InChI

InChI=1S/C15H17N3OS/c19-14-3-2-12(15-16-4-1-5-17-15)10-13(14)11-18-6-8-20-9-7-18/h1-5,10,16H,6-9,11H2/p+1