(E)-2-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-3-(4-tert-butylphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)-3-(4-tert-butylphenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(4-tert-butylphenyl)prop-2-enenitrile CAS Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(4-tert-butylphenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-amino-6-anilino-1,3,5-triazin-2-yl)-3-(4-tert-butylphenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-amino-6-anilino-s-triazin-2-yl)-3-(4-tert-butylphenyl)acrylonitrile Formula: C22H22N6 MolecularWeight: 370.45028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N6/c1-22(2,3)17-11-9-15(10-12-17)13-16(14-23)19-26-20(24)28-21(27-19)25-18-7-5-4-6-8-18/h4-13H,1-3H3,(H3,24,25,26,27,28)/b16-13+