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

Systemtic Name: 5-ethanoyl-1-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-4-naphthalen-1-yl-6-phenyl-2-sulfanylidene-pyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(1-naphthyl)-6-phenyl-2-thioxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]pyridine-3-carbonitrile CAS Name: 5-acetyl-4-(1-naphthalenyl)-6-phenyl-2-sulfanylidene-1-[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-4-naphthalen-1-yl-6-phenyl-2-sulfanylidene-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]pyridine-3-carbonitrile Traditional Name: 5-acetyl-4-(1-naphthyl)-6-phenyl-2-thioxo-1-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)nicotinonitrile Formula: C30H26N2O6S MolecularWeight: 542.60224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C(=S)C(=C1C2=CC=CC3=CC=CC=C32)C#N)C4C(C(C(C(O4)CO)O)O)O)C5=CC=CC=C5

Isomeric SMILES

CC(=O)C1=C(N(C(=S)C(=C1C2=CC=CC3=CC=CC=C32)C#N)C4C(C(C(C(O4)CO)O)O)O)C5=CC=CC=C5

InChI

InChI=1S/C30H26N2O6S/c1-16(34)23-24(20-13-7-11-17-8-5-6-12-19(17)20)21(14-31)30(39)32(25(23)18-9-3-2-4-10-18)29-28(37)27(36)26(35)22(15-33)38-29/h2-13,22,26-29,33,35-37H,15H2,1H3