(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-[2-(2-pyridyl)thiazol-4-yl]acetate CAS Name: 2-[2-(2-pyridinyl)-4-thiazolyl]acetic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(2-pyridyl)thiazol-4-yl]acetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C20H17N7O2S MolecularWeight: 419.45968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CC3=CSC(=N3)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CC3=CSC(=N3)C4=CC=CC=N4

InChI

InChI=1S/C20H17N7O2S/c21-19-25-16(26-20(27-19)24-13-6-2-1-3-7-13)11-29-17(28)10-14-12-30-18(23-14)15-8-4-5-9-22-15/h1-9,12H,10-11H2,(H3,21,24,25,26,27)