2-azanyl-6-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-[[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thio]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-[[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]thio]dinicotinonitrile Formula: C16H10N4O3S MolecularWeight: 338.3406

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

InChI

InChI=1S/C16H10N4O3S/c17-5-10-3-11(6-18)16(20-15(10)19)24-7-12(21)9-1-2-13-14(4-9)23-8-22-13/h1-4H,7-8H2,(H2,19,20)