6-azanyl-2-[(2-azanyl-1,3-thiazol-4-yl)methylsulfanyl]-4-[4-(2-hydroxyethyloxy)phenyl]-5-isocyano-pyridine-3-carbonitrile

Systemtic Name: 6-azanyl-2-[(2-azanyl-1,3-thiazol-4-yl)methylsulfanyl]-4-[4-(2-hydroxyethyloxy)phenyl]-5-isocyano-pyridine-3-carbonitrile Openeye Name: 6-amino-2-[(2-aminothiazol-4-yl)methylsulfanyl]-4-[4-(2-hydroxyethoxy)phenyl]-5-isocyano-pyridine-3-carbonitrile CAS Name: 6-amino-2-[(2-amino-4-thiazolyl)methylthio]-4-[4-(2-hydroxyethoxy)phenyl]-5-isocyano-3-pyridinecarbonitrile IUPAC Name: 6-amino-2-[(2-amino-1,3-thiazol-4-yl)methylsulfanyl]-4-[4-(2-hydroxyethoxy)phenyl]-5-isocyanopyridine-3-carbonitrile Traditional Name: 6-amino-2-[(2-aminothiazol-4-yl)methylthio]-4-[4-(2-hydroxyethoxy)phenyl]-5-isocyano-nicotinonitrile Formula: C19H16N6O2S2 MolecularWeight: 424.49934

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=C(N=C(C(=C1C2=CC=C(C=C2)OCCO)C#N)SCC3=CSC(=N3)N)N

Isomeric SMILES

[C-]#[N+]C1=C(N=C(C(=C1C2=CC=C(C=C2)OCCO)C#N)SCC3=CSC(=N3)N)N

InChI

InChI=1S/C19H16N6O2S2/c1-23-16-15(11-2-4-13(5-3-11)27-7-6-26)14(8-20)18(25-17(16)21)28-9-12-10-29-19(22)24-12/h2-5,10,26H,6-7,9H2,(H2,21,25)(H2,22,24)