(E)-2-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enenitrile CAS Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propenenitrile IUPAC Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-amino-6-anilino-s-triazin-2-yl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]acrylonitrile Formula: C26H19N9 MolecularWeight: 457.48936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)C(=CC3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)/C(=C/C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)/C#N

InChI

InChI=1S/C26H19N9/c27-15-19(24-31-25(28)33-26(32-24)30-21-9-3-1-4-10-21)14-20-17-35(22-11-5-2-6-12-22)34-23(20)18-8-7-13-29-16-18/h1-14,16-17H,(H3,28,30,31,32,33)/b19-14+