2-[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl]sulfanyl-4,5,6-trimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl]sulfanyl-4,5,6-trimethyl-pyridine-3-carbonitrile Openeye Name: 2-[(E)-4-amino-3-cyano-2-oxo-pent-3-enyl]sulfanyl-4,5,6-trimethyl-pyridine-3-carbonitrile CAS Name: 2-[[(E)-4-amino-3-cyano-2-oxopent-3-enyl]thio]-4,5,6-trimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[(E)-4-amino-3-cyano-2-oxopent-3-enyl]sulfanyl-4,5,6-trimethylpyridine-3-carbonitrile Traditional Name: 2-[[(E)-4-amino-3-cyano-2-keto-pent-3-enyl]thio]-4,5,6-trimethyl-nicotinonitrile Formula: C15H16N4OS MolecularWeight: 300.37874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC(=O)C(=C(C)N)C#N)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC(=O)/C(=C(\C)/N)/C#N)C

InChI

InChI=1S/C15H16N4OS/c1-8-9(2)12(5-16)15(19-11(8)4)21-7-14(20)13(6-17)10(3)18/h7,18H2,1-4H3/b13-10+