2,4-bis(azanyl)-7-oxidanyl-5-sulfanyl-2,5,5a,9a-tetrahydro-1H-chromeno[2,3-b]pyridine-3-carbonitrile

Systemtic Name: 2,4-bis(azanyl)-7-oxidanyl-5-sulfanyl-2,5,5a,9a-tetrahydro-1H-chromeno[2,3-b]pyridine-3-carbonitrile Openeye Name: 2,4-diamino-7-hydroxy-5-sulfanyl-2,5,5a,9a-tetrahydro-1H-chromeno[2,3-b]pyridine-3-carbonitrile CAS Name: 2,4-diamino-7-hydroxy-5-mercapto-2,5,5a,9a-tetrahydro-1H-[1]benzopyrano[2,3-b]pyridine-3-carbonitrile IUPAC Name: 2,4-diamino-7-hydroxy-5-sulfanyl-2,5,5a,9a-tetrahydro-1H-chromeno[2,3-b]pyridine-3-carbonitrile Traditional Name: 2,4-diamino-7-hydroxy-5-mercapto-2,5,5a,9a-tetrahydro-1H-chromeno[2,3-b]pyridine-3-carbonitrile Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2C1OC3=C(C2S)C(=C(C(N3)N)C#N)N)O

Isomeric SMILES

C1=CC(=CC2C1OC3=C(C2S)C(=C(C(N3)N)C#N)N)O

InChI

InChI=1S/C13H14N4O2S/c14-4-7-10(15)9-11(20)6-3-5(18)1-2-8(6)19-13(9)17-12(7)16/h1-3,6,8,11-12,17-18,20H,15-16H2