4,5,6-trimethyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,5,6-trimethyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-pyridine-3-carbonitrile Openeye Name: 4,5,6-trimethyl-2-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-pyridine-3-carbonitrile CAS Name: 4,5,6-trimethyl-2-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]-3-pyridinecarbonitrile IUPAC Name: 4,5,6-trimethyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanylpyridine-3-carbonitrile Traditional Name: 4,5,6-trimethyl-2-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]nicotinonitrile Formula: C15H13N3O3S MolecularWeight: 315.34702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SC=CC2=CC=C(O2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)S/C=C/C2=CC=C(O2)[N+](=O)[O-])C

InChI

InChI=1S/C15H13N3O3S/c1-9-10(2)13(8-16)15(17-11(9)3)22-7-6-12-4-5-14(21-12)18(19)20/h4-7H,1-3H3/b7-6+