2-azanyl-4-(5-bromanylthiophen-2-yl)-6-(hydroxymethyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanylthiophen-2-yl)-6-(hydroxymethyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-thienyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-thiophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile IUPAC Name: 2-amino-4-(5-bromothiophen-2-yl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-thienyl)-8-keto-6-methylol-4H-pyrano[3,2-b]pyran-3-carbonitrile Formula: C14H9BrN2O4S MolecularWeight: 381.20126

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)C2C(=C(OC3=C2OC(=CC3=O)CO)N)C#N

Isomeric SMILES

C1=C(SC(=C1)Br)C2C(=C(OC3=C2OC(=CC3=O)CO)N)C#N

InChI

InChI=1S/C14H9BrN2O4S/c15-10-2-1-9(22-10)11-7(4-16)14(17)21-12-8(19)3-6(5-18)20-13(11)12/h1-3,11,18H,5,17H2