2-azanyl-1-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-4-phenyl-6-sulfanylidene-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-1-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-4-phenyl-6-sulfanylidene-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-phenyl-6-thioxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-phenyl-6-sulfanylidene-1-[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-phenyl-6-sulfanylidene-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-phenyl-6-thioxo-1-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)dinicotinonitrile Formula: C19H18N4O5S MolecularWeight: 414.43502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=S)N(C(=C2C#N)N)C3C(C(C(C(O3)CO)O)O)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=S)N(C(=C2C#N)N)C3C(C(C(C(O3)CO)O)O)O)C#N

InChI

InChI=1S/C19H18N4O5S/c20-6-10-13(9-4-2-1-3-5-9)11(7-21)19(29)23(17(10)22)18-16(27)15(26)14(25)12(8-24)28-18/h1-5,12,14-16,18,24-27H,8,22H2