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

Systemtic Name: (E)-2-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(3-ethoxy-4-prop-2-ynoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(3-ethoxy-4-prop-2-ynoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-amino-6-anilino-s-triazin-2-yl)-3-(3-ethoxy-4-propargyloxy-phenyl)acrylonitrile Formula: C23H20N6O2 MolecularWeight: 412.4439

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C2=NC(=NC(=N2)NC3=CC=CC=C3)N)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C2=NC(=NC(=N2)NC3=CC=CC=C3)N)OCC#C

InChI

InChI=1S/C23H20N6O2/c1-3-12-31-19-11-10-16(14-20(19)30-4-2)13-17(15-24)21-27-22(25)29-23(28-21)26-18-8-6-5-7-9-18/h1,5-11,13-14H,4,12H2,2H3,(H3,25,26,27,28,29)/b17-13+